N-[1-[[1-cyano-2-(phenylmethylsulfanyl)ethyl]amino]-4,4-dimethyl-1-oxidanylidene-pentan-2-yl]morpholine-4-carboxamide

Systemtic Name: N-[1-[[1-cyano-2-(phenylmethylsulfanyl)ethyl]amino]-4,4-dimethyl-1-oxidanylidene-pentan-2-yl]morpholine-4-carboxamide Openeye Name: N-[1-[(2-benzylsulfanyl-1-cyano-ethyl)carbamoyl]-3,3-dimethyl-butyl]morpholine-4-carboxamide CAS Name: N-[1-[[1-cyano-2-(phenylmethylthio)ethyl]amino]-4,4-dimethyl-1-oxopentan-2-yl]-4-morpholinecarboxamide IUPAC Name: N-[1-[(2-benzylsulfanyl-1-cyanoethyl)amino]-4,4-dimethyl-1-oxopentan-2-yl]morpholine-4-carboxamide Traditional Name: N-[1-[[2-(benzylthio)-1-cyano-ethyl]carbamoyl]-3,3-dimethyl-butyl]morpholine-4-carboxamide Formula: C22H32N4O3S MolecularWeight: 432.57948

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(C(=O)NC(CSCC1=CC=CC=C1)C#N)NC(=O)N2CCOCC2

Isomeric SMILES

CC(C)(C)CC(C(=O)NC(CSCC1=CC=CC=C1)C#N)NC(=O)N2CCOCC2

InChI

InChI=1S/C22H32N4O3S/c1-22(2,3)13-19(25-21(28)26-9-11-29-12-10-26)20(27)24-18(14-23)16-30-15-17-7-5-4-6-8-17/h4-8,18-19H,9-13,15-16H2,1-3H3,(H,24,27)(H,25,28)