5-bromanyl-N-[(8-methoxy-1-methyl-5-phenyl-2,3-dihydro-1,4-benzodiazepin-2-yl)methyl]thiophene-2-carboxamide

Systemtic Name: 5-bromanyl-N-[(8-methoxy-1-methyl-5-phenyl-2,3-dihydro-1,4-benzodiazepin-2-yl)methyl]thiophene-2-carboxamide Openeye Name: 5-bromo-N-[(8-methoxy-1-methyl-5-phenyl-2,3-dihydro-1,4-benzodiazepin-2-yl)methyl]thiophene-2-carboxamide CAS Name: 5-bromo-N-[(8-methoxy-1-methyl-5-phenyl-2,3-dihydro-1,4-benzodiazepin-2-yl)methyl]-2-thiophenecarboxamide IUPAC Name: 5-bromo-N-[(8-methoxy-1-methyl-5-phenyl-2,3-dihydro-1,4-benzodiazepin-2-yl)methyl]thiophene-2-carboxamide Traditional Name: 5-bromo-N-[(8-methoxy-1-methyl-5-phenyl-2,3-dihydro-1,4-benzodiazepin-2-yl)methyl]thiophene-2-carboxamide Formula: C23H22BrN3O2S MolecularWeight: 484.40868

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(CN=C(C2=C1C=C(C=C2)OC)C3=CC=CC=C3)CNC(=O)C4=CC=C(S4)Br

Isomeric SMILES

CN1C(CN=C(C2=C1C=C(C=C2)OC)C3=CC=CC=C3)CNC(=O)C4=CC=C(S4)Br

InChI

InChI=1S/C23H22BrN3O2S/c1-27-16(14-26-23(28)20-10-11-21(24)30-20)13-25-22(15-6-4-3-5-7-15)18-9-8-17(29-2)12-19(18)27/h3-12,16H,13-14H2,1-2H3,(H,26,28)