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

Systemtic Name: 7-(1,4-diazepan-1-ylcarbonyl)-2-(4-methylphenyl)-1-(2-thiophen-2-ylethanoyl)-3,5-dihydro-2H-1,5-benzodiazepin-4-one Openeye Name: 7-(1,4-diazepane-1-carbonyl)-2-(p-tolyl)-1-[2-(2-thienyl)acetyl]-3,5-dihydro-2H-1,5-benzodiazepin-4-one CAS Name: 7-[1,4-diazepan-1-yl(oxo)methyl]-2-(4-methylphenyl)-1-(1-oxo-2-thiophen-2-ylethyl)-3,5-dihydro-2H-1,5-benzodiazepin-4-one IUPAC Name: 7-(1,4-diazepane-1-carbonyl)-2-(4-methylphenyl)-1-(2-thiophen-2-ylacetyl)-3,5-dihydro-2H-1,5-benzodiazepin-4-one Traditional Name: 7-(1,4-diazepane-1-carbonyl)-2-(p-tolyl)-1-[2-(2-thienyl)acetyl]-3,5-dihydro-2H-1,5-benzodiazepin-4-one Formula: C28H30N4O3S MolecularWeight: 502.6278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2CC(=O)NC3=C(N2C(=O)CC4=CC=CS4)C=CC(=C3)C(=O)N5CCCNCC5

Isomeric SMILES

CC1=CC=C(C=C1)C2CC(=O)NC3=C(N2C(=O)CC4=CC=CS4)C=CC(=C3)C(=O)N5CCCNCC5

InChI

InChI=1S/C28H30N4O3S/c1-19-5-7-20(8-6-19)25-18-26(33)30-23-16-21(28(35)31-13-3-11-29-12-14-31)9-10-24(23)32(25)27(34)17-22-4-2-15-36-22/h2,4-10,15-16,25,29H,3,11-14,17-18H2,1H3,(H,30,33)