tert-butyl N-[1-[[4-cyano-1-(phenylmethyl)pyrrolidin-3-yl]carbamoyl]cyclohexyl]carbamate

Systemtic Name: tert-butyl N-[1-[[4-cyano-1-(phenylmethyl)pyrrolidin-3-yl]carbamoyl]cyclohexyl]carbamate Openeye Name: tert-butyl N-[1-[(1-benzyl-4-cyano-pyrrolidin-3-yl)carbamoyl]cyclohexyl]carbamate CAS Name: N-[1-[[[4-cyano-1-(phenylmethyl)-3-pyrrolidinyl]amino]-oxomethyl]cyclohexyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-[(1-benzyl-4-cyanopyrrolidin-3-yl)carbamoyl]cyclohexyl]carbamate Traditional Name: N-[1-[(1-benzyl-4-cyano-pyrrolidin-3-yl)carbamoyl]cyclohexyl]carbamic acid tert-butyl ester Formula: C24H34N4O3 MolecularWeight: 426.55176

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1(CCCCC1)C(=O)NC2CN(CC2C#N)CC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)NC1(CCCCC1)C(=O)NC2CN(CC2C#N)CC3=CC=CC=C3

InChI

InChI=1S/C24H34N4O3/c1-23(2,3)31-22(30)27-24(12-8-5-9-13-24)21(29)26-20-17-28(16-19(20)14-25)15-18-10-6-4-7-11-18/h4,6-7,10-11,19-20H,5,8-9,12-13,15-17H2,1-3H3,(H,26,29)(H,27,30)