N-[(1-methyl-7-nitro-2,3-dihydro-1,4-benzodiazepin-2-yl)methyl]thiophene-2-carboxamide hydrochloride

Systemtic Name: N-[(1-methyl-7-nitro-2,3-dihydro-1,4-benzodiazepin-2-yl)methyl]thiophene-2-carboxamide hydrochloride Openeye Name: N-[(1-methyl-7-nitro-2,3-dihydro-1,4-benzodiazepin-2-yl)methyl]thiophene-2-carboxamide hydrochloride CAS Name: N-[(1-methyl-7-nitro-2,3-dihydro-1,4-benzodiazepin-2-yl)methyl]-2-thiophenecarboxamide hydrochloride IUPAC Name: N-[(1-methyl-7-nitro-2,3-dihydro-1,4-benzodiazepin-2-yl)methyl]thiophene-2-carboxamide hydrochloride Traditional Name: N-[(1-methyl-7-nitro-2,3-dihydro-1,4-benzodiazepin-2-yl)methyl]thiophene-2-carboxamide hydrochloride Formula: C16H17ClN4O3S MolecularWeight: 380.84918

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(CN=CC2=C1C=CC(=C2)[N+](=O)[O-])CNC(=O)C3=CC=CS3.Cl

Isomeric SMILES

CN1C(CN=CC2=C1C=CC(=C2)[N+](=O)[O-])CNC(=O)C3=CC=CS3.Cl

InChI

InChI=1S/C16H16N4O3S.ClH/c1-19-13(10-18-16(21)15-3-2-6-24-15)9-17-8-11-7-12(20(22)23)4-5-14(11)19;/h2-8,13H,9-10H2,1H3,(H,18,21);1H