7-(1,4-diazepan-1-ylcarbonyl)-2-(4-methylphenyl)-1-thiophen-2-ylcarbonyl-3,5-dihydro-2H-1,5-benzodiazepin-4-one

Systemtic Name: 7-(1,4-diazepan-1-ylcarbonyl)-2-(4-methylphenyl)-1-thiophen-2-ylcarbonyl-3,5-dihydro-2H-1,5-benzodiazepin-4-one Openeye Name: 7-(1,4-diazepane-1-carbonyl)-2-(p-tolyl)-1-(thiophene-2-carbonyl)-3,5-dihydro-2H-1,5-benzodiazepin-4-one CAS Name: 7-[1,4-diazepan-1-yl(oxo)methyl]-2-(4-methylphenyl)-1-[oxo(thiophen-2-yl)methyl]-3,5-dihydro-2H-1,5-benzodiazepin-4-one IUPAC Name: 7-(1,4-diazepane-1-carbonyl)-2-(4-methylphenyl)-1-(thiophene-2-carbonyl)-3,5-dihydro-2H-1,5-benzodiazepin-4-one Traditional Name: 7-(1,4-diazepane-1-carbonyl)-2-(p-tolyl)-1-(2-thenoyl)-3,5-dihydro-2H-1,5-benzodiazepin-4-one Formula: C27H28N4O3S MolecularWeight: 488.60122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2CC(=O)NC3=C(N2C(=O)C4=CC=CS4)C=CC(=C3)C(=O)N5CCCNCC5

Isomeric SMILES

CC1=CC=C(C=C1)C2CC(=O)NC3=C(N2C(=O)C4=CC=CS4)C=CC(=C3)C(=O)N5CCCNCC5

InChI

InChI=1S/C27H28N4O3S/c1-18-5-7-19(8-6-18)23-17-25(32)29-21-16-20(26(33)30-13-3-11-28-12-14-30)9-10-22(21)31(23)27(34)24-4-2-15-35-24/h2,4-10,15-16,23,28H,3,11-14,17H2,1H3,(H,29,32)