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

Systemtic Name: 2-cyclohexyl-7-(1,4-diazepan-1-ylcarbonyl)-1-thiophen-2-ylcarbonyl-3,5-dihydro-2H-1,5-benzodiazepin-4-one Openeye Name: 2-cyclohexyl-7-(1,4-diazepane-1-carbonyl)-1-(thiophene-2-carbonyl)-3,5-dihydro-2H-1,5-benzodiazepin-4-one CAS Name: 2-cyclohexyl-7-[1,4-diazepan-1-yl(oxo)methyl]-1-[oxo(thiophen-2-yl)methyl]-3,5-dihydro-2H-1,5-benzodiazepin-4-one IUPAC Name: 2-cyclohexyl-7-(1,4-diazepane-1-carbonyl)-1-(thiophene-2-carbonyl)-3,5-dihydro-2H-1,5-benzodiazepin-4-one Traditional Name: 2-cyclohexyl-7-(1,4-diazepane-1-carbonyl)-1-(2-thenoyl)-3,5-dihydro-2H-1,5-benzodiazepin-4-one Formula: C26H32N4O3S MolecularWeight: 480.62228

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2CC(=O)NC3=C(N2C(=O)C4=CC=CS4)C=CC(=C3)C(=O)N5CCCNCC5

Isomeric SMILES

C1CCC(CC1)C2CC(=O)NC3=C(N2C(=O)C4=CC=CS4)C=CC(=C3)C(=O)N5CCCNCC5

InChI

InChI=1S/C26H32N4O3S/c31-24-17-22(18-6-2-1-3-7-18)30(26(33)23-8-4-15-34-23)21-10-9-19(16-20(21)28-24)25(32)29-13-5-11-27-12-14-29/h4,8-10,15-16,18,22,27H,1-3,5-7,11-14,17H2,(H,28,31)