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

Systemtic Name: tert-butyl N-[3-(cyclohexylmethylsulfanyl)-1-[(4-dimethylaminophenyl)methylamino]-1-oxidanylidene-propan-2-yl]carbamate Openeye Name: tert-butyl N-[1-(cyclohexylmethylsulfanylmethyl)-2-[(4-dimethylaminophenyl)methylamino]-2-oxo-ethyl]carbamate CAS Name: N-[3-(cyclohexylmethylthio)-1-[(4-dimethylaminophenyl)methylamino]-1-oxopropan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-(cyclohexylmethylsulfanyl)-1-[(4-dimethylaminophenyl)methylamino]-1-oxopropan-2-yl]carbamate Traditional Name: N-[1-[(cyclohexylmethylthio)methyl]-2-[[4-(dimethylamino)benzyl]amino]-2-keto-ethyl]carbamic acid tert-butyl ester Formula: C24H39N3O3S MolecularWeight: 449.64976

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CSCC1CCCCC1)C(=O)NCC2=CC=C(C=C2)N(C)C

Isomeric SMILES

CC(C)(C)OC(=O)NC(CSCC1CCCCC1)C(=O)NCC2=CC=C(C=C2)N(C)C

InChI

InChI=1S/C24H39N3O3S/c1-24(2,3)30-23(29)26-21(17-31-16-19-9-7-6-8-10-19)22(28)25-15-18-11-13-20(14-12-18)27(4)5/h11-14,19,21H,6-10,15-17H2,1-5H3,(H,25,28)(H,26,29)