1-[1-cyclohexyl-4-oxidanylidene-5-(2-oxidanylidene-2-thiophen-2-yl-ethyl)-2,3-dihydro-1,5-benzodiazepin-3-yl]urea

Systemtic Name: 1-[1-cyclohexyl-4-oxidanylidene-5-(2-oxidanylidene-2-thiophen-2-yl-ethyl)-2,3-dihydro-1,5-benzodiazepin-3-yl]urea Openeye Name: [1-cyclohexyl-4-oxo-5-[2-oxo-2-(2-thienyl)ethyl]-2,3-dihydro-1,5-benzodiazepin-3-yl]urea CAS Name: [1-cyclohexyl-4-oxo-5-(2-oxo-2-thiophen-2-ylethyl)-2,3-dihydro-1,5-benzodiazepin-3-yl]urea IUPAC Name: [1-cyclohexyl-4-oxo-5-(2-oxo-2-thiophen-2-ylethyl)-2,3-dihydro-1,5-benzodiazepin-3-yl]urea Traditional Name: [1-cyclohexyl-4-keto-5-[2-keto-2-(2-thienyl)ethyl]-2,3-dihydro-1,5-benzodiazepin-3-yl]urea Formula: C22H26N4O3S MolecularWeight: 426.53184

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2CC(C(=O)N(C3=CC=CC=C32)CC(=O)C4=CC=CS4)NC(=O)N

Isomeric SMILES

C1CCC(CC1)N2CC(C(=O)N(C3=CC=CC=C32)CC(=O)C4=CC=CS4)NC(=O)N

InChI

InChI=1S/C22H26N4O3S/c23-22(29)24-16-13-25(15-7-2-1-3-8-15)17-9-4-5-10-18(17)26(21(16)28)14-19(27)20-11-6-12-30-20/h4-6,9-12,15-16H,1-3,7-8,13-14H2,(H3,23,24,29)