1-[1-cyclooctyl-5-(3,3-dimethyl-2-oxidanylidene-butyl)-4-oxidanylidene-2,3-dihydro-1,5-benzodiazepin-3-yl]urea

Systemtic Name: 1-[1-cyclooctyl-5-(3,3-dimethyl-2-oxidanylidene-butyl)-4-oxidanylidene-2,3-dihydro-1,5-benzodiazepin-3-yl]urea Openeye Name: [1-cyclooctyl-5-(3,3-dimethyl-2-oxo-butyl)-4-oxo-2,3-dihydro-1,5-benzodiazepin-3-yl]urea CAS Name: [1-cyclooctyl-5-(3,3-dimethyl-2-oxobutyl)-4-oxo-2,3-dihydro-1,5-benzodiazepin-3-yl]urea IUPAC Name: [1-cyclooctyl-5-(3,3-dimethyl-2-oxobutyl)-4-oxo-2,3-dihydro-1,5-benzodiazepin-3-yl]urea Traditional Name: [1-cyclooctyl-4-keto-5-(2-keto-3,3-dimethyl-butyl)-2,3-dihydro-1,5-benzodiazepin-3-yl]urea Formula: C24H36N4O3 MolecularWeight: 428.56764

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)CN1C2=CC=CC=C2N(CC(C1=O)NC(=O)N)C3CCCCCCC3

Isomeric SMILES

CC(C)(C)C(=O)CN1C2=CC=CC=C2N(CC(C1=O)NC(=O)N)C3CCCCCCC3

InChI

InChI=1S/C24H36N4O3/c1-24(2,3)21(29)16-28-20-14-10-9-13-19(20)27(15-18(22(28)30)26-23(25)31)17-11-7-5-4-6-8-12-17/h9-10,13-14,17-18H,4-8,11-12,15-16H2,1-3H3,(H3,25,26,31)