[1-[(1-cyano-3-methyl-butyl)amino]-3-cyclopropyl-1-oxidanylidene-propan-2-yl] N-(phenylmethyl)carbamate

Systemtic Name: [1-[(1-cyano-3-methyl-butyl)amino]-3-cyclopropyl-1-oxidanylidene-propan-2-yl] N-(phenylmethyl)carbamate Openeye Name: [2-[(1-cyano-3-methyl-butyl)amino]-1-(cyclopropylmethyl)-2-oxo-ethyl] N-benzylcarbamate CAS Name: N-(phenylmethyl)carbamic acid [1-[(1-cyano-3-methylbutyl)amino]-3-cyclopropyl-1-oxopropan-2-yl] ester IUPAC Name: [1-[(1-cyano-3-methylbutyl)amino]-3-cyclopropyl-1-oxopropan-2-yl] N-benzylcarbamate Traditional Name: N-benzylcarbamic acid [2-[(1-cyano-3-methyl-butyl)amino]-1-(cyclopropylmethyl)-2-keto-ethyl] ester Formula: C20H27N3O3 MolecularWeight: 357.44668

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C#N)NC(=O)C(CC1CC1)OC(=O)NCC2=CC=CC=C2

Isomeric SMILES

CC(C)CC(C#N)NC(=O)C(CC1CC1)OC(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C20H27N3O3/c1-14(2)10-17(12-21)23-19(24)18(11-15-8-9-15)26-20(25)22-13-16-6-4-3-5-7-16/h3-7,14-15,17-18H,8-11,13H2,1-2H3,(H,22,25)(H,23,24)