1-(4-aminophenyl)-8-azanyl-N,4-dimethyl-7-methylsulfanyl-4,5-dihydro-2,3-benzodiazepine-3-carboxamide

Systemtic Name: 1-(4-aminophenyl)-8-azanyl-N,4-dimethyl-7-methylsulfanyl-4,5-dihydro-2,3-benzodiazepine-3-carboxamide Openeye Name: 8-amino-1-(4-aminophenyl)-N,4-dimethyl-7-methylsulfanyl-4,5-dihydro-2,3-benzodiazepine-3-carboxamide CAS Name: 8-amino-1-(4-aminophenyl)-N,4-dimethyl-7-(methylthio)-4,5-dihydro-2,3-benzodiazepine-3-carboxamide IUPAC Name: 8-amino-1-(4-aminophenyl)-N,4-dimethyl-7-methylsulfanyl-4,5-dihydro-2,3-benzodiazepine-3-carboxamide Traditional Name: 8-amino-1-(4-aminophenyl)-N,4-dimethyl-7-(methylthio)-4,5-dihydro-2,3-benzodiazepine-3-carboxamide Formula: C19H23N5OS MolecularWeight: 369.48382

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC(=C(C=C2C(=NN1C(=O)NC)C3=CC=C(C=C3)N)N)SC

Isomeric SMILES

CC1CC2=CC(=C(C=C2C(=NN1C(=O)NC)C3=CC=C(C=C3)N)N)SC

InChI

InChI=1S/C19H23N5OS/c1-11-8-13-9-17(26-3)16(21)10-15(13)18(23-24(11)19(25)22-2)12-4-6-14(20)7-5-12/h4-7,9-11H,8,20-21H2,1-3H3,(H,22,25)