1-[7-methyl-4-oxidanylidene-5-(2-oxidanylidene-2-thiophen-2-yl-ethyl)-1-thiophen-2-ylcarbonyl-2,3-dihydro-1,5-benzodiazepin-3-yl]urea

Systemtic Name: 1-[7-methyl-4-oxidanylidene-5-(2-oxidanylidene-2-thiophen-2-yl-ethyl)-1-thiophen-2-ylcarbonyl-2,3-dihydro-1,5-benzodiazepin-3-yl]urea Openeye Name: [7-methyl-4-oxo-5-[2-oxo-2-(2-thienyl)ethyl]-1-(thiophene-2-carbonyl)-2,3-dihydro-1,5-benzodiazepin-3-yl]urea CAS Name: [7-methyl-4-oxo-5-(2-oxo-2-thiophen-2-ylethyl)-1-[oxo(thiophen-2-yl)methyl]-2,3-dihydro-1,5-benzodiazepin-3-yl]urea IUPAC Name: [7-methyl-4-oxo-5-(2-oxo-2-thiophen-2-ylethyl)-1-(thiophene-2-carbonyl)-2,3-dihydro-1,5-benzodiazepin-3-yl]urea Traditional Name: [4-keto-5-[2-keto-2-(2-thienyl)ethyl]-7-methyl-1-(2-thenoyl)-2,3-dihydro-1,5-benzodiazepin-3-yl]urea Formula: C22H20N4O4S2 MolecularWeight: 468.5486

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(CC(C(=O)N2CC(=O)C3=CC=CS3)NC(=O)N)C(=O)C4=CC=CS4

Isomeric SMILES

CC1=CC2=C(C=C1)N(CC(C(=O)N2CC(=O)C3=CC=CS3)NC(=O)N)C(=O)C4=CC=CS4

InChI

InChI=1S/C22H20N4O4S2/c1-13-6-7-15-16(10-13)26(12-17(27)18-4-2-8-31-18)20(28)14(24-22(23)30)11-25(15)21(29)19-5-3-9-32-19/h2-10,14H,11-12H2,1H3,(H3,23,24,30)