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

Systemtic Name: 1-[1-cyclopentylcarbonyl-7-methyl-5-[2-(2-methylphenyl)-2-oxidanylidene-ethyl]-4-oxidanylidene-2,3-dihydro-1,5-benzodiazepin-3-yl]urea Openeye Name: [1-(cyclopentanecarbonyl)-7-methyl-5-[2-(o-tolyl)-2-oxo-ethyl]-4-oxo-2,3-dihydro-1,5-benzodiazepin-3-yl]urea CAS Name: [1-[cyclopentyl(oxo)methyl]-7-methyl-5-[2-(2-methylphenyl)-2-oxoethyl]-4-oxo-2,3-dihydro-1,5-benzodiazepin-3-yl]urea IUPAC Name: [1-(cyclopentanecarbonyl)-7-methyl-5-[2-(2-methylphenyl)-2-oxoethyl]-4-oxo-2,3-dihydro-1,5-benzodiazepin-3-yl]urea Traditional Name: [1-(cyclopentanecarbonyl)-4-keto-5-[2-keto-2-(o-tolyl)ethyl]-7-methyl-2,3-dihydro-1,5-benzodiazepin-3-yl]urea Formula: C26H30N4O4 MolecularWeight: 462.5408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(CC(C(=O)N2CC(=O)C3=CC=CC=C3C)NC(=O)N)C(=O)C4CCCC4

Isomeric SMILES

CC1=CC2=C(C=C1)N(CC(C(=O)N2CC(=O)C3=CC=CC=C3C)NC(=O)N)C(=O)C4CCCC4

InChI

InChI=1S/C26H30N4O4/c1-16-11-12-21-22(13-16)30(15-23(31)19-10-6-3-7-17(19)2)25(33)20(28-26(27)34)14-29(21)24(32)18-8-4-5-9-18/h3,6-7,10-13,18,20H,4-5,8-9,14-15H2,1-2H3,(H3,27,28,34)