N-[(1,7-dimethyl-5-phenyl-2,3-dihydro-1,4-benzodiazepin-2-yl)methyl]thiophene-3-carboxamide

Systemtic Name: N-[(1,7-dimethyl-5-phenyl-2,3-dihydro-1,4-benzodiazepin-2-yl)methyl]thiophene-3-carboxamide Openeye Name: N-[(1,7-dimethyl-5-phenyl-2,3-dihydro-1,4-benzodiazepin-2-yl)methyl]thiophene-3-carboxamide CAS Name: N-[(1,7-dimethyl-5-phenyl-2,3-dihydro-1,4-benzodiazepin-2-yl)methyl]-3-thiophenecarboxamide IUPAC Name: N-[(1,7-dimethyl-5-phenyl-2,3-dihydro-1,4-benzodiazepin-2-yl)methyl]thiophene-3-carboxamide Traditional Name: N-[(1,7-dimethyl-5-phenyl-2,3-dihydro-1,4-benzodiazepin-2-yl)methyl]thiophene-3-carboxamide Formula: C23H23N3OS MolecularWeight: 389.51322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(CN=C2C3=CC=CC=C3)CNC(=O)C4=CSC=C4)C

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(CN=C2C3=CC=CC=C3)CNC(=O)C4=CSC=C4)C

InChI

InChI=1S/C23H23N3OS/c1-16-8-9-21-20(12-16)22(17-6-4-3-5-7-17)24-13-19(26(21)2)14-25-23(27)18-10-11-28-15-18/h3-12,15,19H,13-14H2,1-2H3,(H,25,27)