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Summary

Name:	6-cyclopropyl-3-{[(4S)-1-methyl-4-phenyl-4,5-dihydro-1H-imidazol-2-yl]methoxy}-N-[(3R)-oxolan-3-yl]pyrazine-2-carboxamide
Formula:	C23 H27 N5 O3
Formal charge:	0
Formula weight:	421.492 Da
Component type:	non-polymer

Chemical Identifiers

Program	Version	Name
ACDLabs	12.01	6-cyclopropyl-3-{[(4S)-1-methyl-4-phenyl-4,5-dihydro-1H-imidazol-2-yl]methoxy}-N-[(3R)-oxolan-3-yl]pyrazine-2-carboxamide
OpenEye OEToolkits	2.0.7	6-cyclopropyl-3-[(1-methyl-4-phenyl-4,5-dihydroimidazol-2-yl)methoxy]-~{N}-[(3~{S})-oxolan-3-yl]pyrazine-2-carboxamide

Chemical Descriptors

Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	O=C(NC1CCOC1)c1nc(cnc1OCC1=NC(CN1C)c1ccccc1)C1CC1
InChI	InChI	1.03	InChI=1S/C23H27N5O3/c1-28-12-19(15-5-3-2-4-6-15)26-20(28)14-31-23-21(22(29)25-17-9-10-30-13-17)27-18(11-24-23)16-7-8-16/h2-6,11,16-17,19H,7-10,12-14H2,1H3,(H,25,29)/t17?,19-/m1/s1
InChIKey	InChI	1.03	MLECUKPIXKDSAC-WHCXFUJUSA-N
SMILES_CANONICAL	CACTVS	3.385	CN1C[C@@H](N=C1COc2ncc(nc2C(=O)N[C@@H]3CCOC3)C4CC4)c5ccccc5
SMILES	CACTVS	3.385	CN1C[CH](N=C1COc2ncc(nc2C(=O)N[CH]3CCOC3)C4CC4)c5ccccc5
SMILES_CANONICAL	OpenEye OEToolkits	2.0.7	CN1CC(N=C1COc2c(nc(cn2)C3CC3)C(=O)N[C@H]4CCOC4)c5ccccc5
SMILES	OpenEye OEToolkits	2.0.7	CN1CC(N=C1COc2c(nc(cn2)C3CC3)C(=O)NC4CCOC4)c5ccccc5

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