1-[5-[2-(2-methylphenyl)-2-oxidanylidene-ethyl]-4-oxidanylidene-1-pyrrolidin-2-ylcarbonyl-2,3-dihydro-1,5-benzodiazepin-3-yl]urea

Systemtic Name: 1-[5-[2-(2-methylphenyl)-2-oxidanylidene-ethyl]-4-oxidanylidene-1-pyrrolidin-2-ylcarbonyl-2,3-dihydro-1,5-benzodiazepin-3-yl]urea Openeye Name: [5-[2-(o-tolyl)-2-oxo-ethyl]-4-oxo-1-(pyrrolidine-2-carbonyl)-2,3-dihydro-1,5-benzodiazepin-3-yl]urea CAS Name: [5-[2-(2-methylphenyl)-2-oxoethyl]-4-oxo-1-[oxo(2-pyrrolidinyl)methyl]-2,3-dihydro-1,5-benzodiazepin-3-yl]urea IUPAC Name: [5-[2-(2-methylphenyl)-2-oxoethyl]-4-oxo-1-(pyrrolidine-2-carbonyl)-2,3-dihydro-1,5-benzodiazepin-3-yl]urea Traditional Name: [4-keto-5-[2-keto-2-(o-tolyl)ethyl]-1-prolyl-2,3-dihydro-1,5-benzodiazepin-3-yl]urea Formula: C24H27N5O4 MolecularWeight: 449.50228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)CN2C3=CC=CC=C3N(CC(C2=O)NC(=O)N)C(=O)C4CCCN4

Isomeric SMILES

CC1=CC=CC=C1C(=O)CN2C3=CC=CC=C3N(CC(C2=O)NC(=O)N)C(=O)C4CCCN4

InChI

InChI=1S/C24H27N5O4/c1-15-7-2-3-8-16(15)21(30)14-29-20-11-5-4-10-19(20)28(22(31)17-9-6-12-26-17)13-18(23(29)32)27-24(25)33/h2-5,7-8,10-11,17-18,26H,6,9,12-14H2,1H3,(H3,25,27,33)