tert-butyl N-[3-(cyclohexylmethylsulfanyl)-1-oxidanylidene-1-[(4-phenylmethoxyphenyl)methylamino]propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[3-(cyclohexylmethylsulfanyl)-1-oxidanylidene-1-[(4-phenylmethoxyphenyl)methylamino]propan-2-yl]carbamate Openeye Name: tert-butyl N-[2-[(4-benzyloxyphenyl)methylamino]-1-(cyclohexylmethylsulfanylmethyl)-2-oxo-ethyl]carbamate CAS Name: N-[3-(cyclohexylmethylthio)-1-oxo-1-[(4-phenylmethoxyphenyl)methylamino]propan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-(cyclohexylmethylsulfanyl)-1-oxo-1-[(4-phenylmethoxyphenyl)methylamino]propan-2-yl]carbamate Traditional Name: N-[2-[(4-benzoxybenzyl)amino]-1-[(cyclohexylmethylthio)methyl]-2-keto-ethyl]carbamic acid tert-butyl ester Formula: C29H40N2O4S MolecularWeight: 512.7039

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CSCC1CCCCC1)C(=O)NCC2=CC=C(C=C2)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)NC(CSCC1CCCCC1)C(=O)NCC2=CC=C(C=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C29H40N2O4S/c1-29(2,3)35-28(33)31-26(21-36-20-24-12-8-5-9-13-24)27(32)30-18-22-14-16-25(17-15-22)34-19-23-10-6-4-7-11-23/h4,6-7,10-11,14-17,24,26H,5,8-9,12-13,18-21H2,1-3H3,(H,30,32)(H,31,33)