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NCE

Summary
Name:3,6-Bis[(3-morpholinopropionamido)] acridine
Synonyms:N,N'-acridine-3,6-diylbis(3-morpholin-4-ylpropanamide)
Formula:C27 H33 N5 O4
Formal charge:0
Formula weight:491.582 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs10.04N,N'-acridine-3,6-diylbis(3-morpholin-4-ylpropanamide)
OpenEye OEToolkits1.5.03-morpholin-4-yl-N-[6-(3-morpholin-4-ylpropanoylamino)acridin-3-yl]propanamide

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04O=C(Nc3cc2nc1cc(ccc1cc2cc3)NC(=O)CCN4CCOCC4)CCN5CCOCC5
SMILES_CANONICALCACTVS3.341O=C(CCN1CCOCC1)Nc2ccc3cc4ccc(NC(=O)CCN5CCOCC5)cc4nc3c2
SMILESCACTVS3.341O=C(CCN1CCOCC1)Nc2ccc3cc4ccc(NC(=O)CCN5CCOCC5)cc4nc3c2
SMILES_CANONICALOpenEye OEToolkits1.5.0c1cc(cc2c1cc3ccc(cc3n2)NC(=O)CCN4CCOCC4)NC(=O)CCN5CCOCC5
SMILESOpenEye OEToolkits1.5.0c1cc(cc2c1cc3ccc(cc3n2)NC(=O)CCN4CCOCC4)NC(=O)CCN5CCOCC5
InChIInChI1.03InChI=1S/C27H33N5O4/c33-26(5-7-31-9-13-35-14-10-31)28-22-3-1-20-17-21-2-4-23(19-25(21)30-24(20)18-22)29-27(34)6-8-32-11-15-36-16-12-32/h1-4,17-19H,5-16H2,(H,28,33)(H,29,34)
InChIKeyInChI1.03PKCWQSROJQAQMV-UHFFFAOYSA-N

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건을2024-07-10부터공개중

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