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8E1

Summary
Name:4-{[(Z)-(7-oxo-6,7-dihydro-8H-[1,3]thiazolo[5,4-e]indol-8-ylidene)methyl]amino}benzene-1-sulfonamide
Formula:C16 H12 N4 O3 S2
Formal charge:0
Formula weight:372.421 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.014-{[(Z)-(7-oxo-6,7-dihydro-8H-[1,3]thiazolo[5,4-e]indol-8-ylidene)methyl]amino}benzene-1-sulfonamide
OpenEye OEToolkits2.0.64-[[(~{Z})-(7-oxidanylidene-6~{H}-pyrrolo[2,3-g][1,3]benzothiazol-8-ylidene)methyl]amino]benzenesulfonamide

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01c1cc(ccc1S(=O)(=O)N)N\C=C4\c2c(ccc3ncsc23)NC4=O
InChIInChI1.03InChI=1S/C16H12N4O3S2/c17-25(22,23)10-3-1-9(2-4-10)18-7-11-14-12(20-16(11)21)5-6-13-15(14)24-8-19-13/h1-8,18H,(H,20,21)(H2,17,22,23)/b11-7-
InChIKeyInChI1.03LTYGAJVXAFJKSY-XFFZJAGNSA-N
SMILES_CANONICALCACTVS3.385N[S](=O)(=O)c1ccc(N\C=C\2C(=O)Nc3ccc4ncsc4c\23)cc1
SMILESCACTVS3.385N[S](=O)(=O)c1ccc(NC=C2C(=O)Nc3ccc4ncsc4c23)cc1
SMILES_CANONICALOpenEye OEToolkits2.0.6c1cc(ccc1N/C=C\2/c3c(ccc4c3scn4)NC2=O)S(=O)(=O)N
SMILESOpenEye OEToolkits2.0.6c1cc(ccc1NC=C2c3c(ccc4c3scn4)NC2=O)S(=O)(=O)N

222415

건을2024-07-10부터공개중

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