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

Systemtic Name: tert-butyl N-[3-(cyclopentylmethylsulfanyl)-1-[(4-methoxyphenyl)methylamino]-1-oxidanylidene-propan-2-yl]carbamate Openeye Name: tert-butyl N-[1-(cyclopentylmethylsulfanylmethyl)-2-[(4-methoxyphenyl)methylamino]-2-oxo-ethyl]carbamate CAS Name: N-[3-(cyclopentylmethylthio)-1-[(4-methoxyphenyl)methylamino]-1-oxopropan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-(cyclopentylmethylsulfanyl)-1-[(4-methoxyphenyl)methylamino]-1-oxopropan-2-yl]carbamate Traditional Name: N-[1-[(cyclopentylmethylthio)methyl]-2-keto-2-(p-anisylamino)ethyl]carbamic acid tert-butyl ester Formula: C22H34N2O4S MolecularWeight: 422.58136

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CSCC1CCCC1)C(=O)NCC2=CC=C(C=C2)OC

Isomeric SMILES

CC(C)(C)OC(=O)NC(CSCC1CCCC1)C(=O)NCC2=CC=C(C=C2)OC

InChI

InChI=1S/C22H34N2O4S/c1-22(2,3)28-21(26)24-19(15-29-14-17-7-5-6-8-17)20(25)23-13-16-9-11-18(27-4)12-10-16/h9-12,17,19H,5-8,13-15H2,1-4H3,(H,23,25)(H,24,26)