ethyl 2-[[2-[ethanoyl-(phenylmethyl)amino]-3,3-dimethyl-butanethioyl]amino]ethanoate

Systemtic Name: ethyl 2-[[2-[ethanoyl-(phenylmethyl)amino]-3,3-dimethyl-butanethioyl]amino]ethanoate Openeye Name: ethyl 2-[[2-[acetyl(benzyl)amino]-3,3-dimethyl-butanethioyl]amino]acetate CAS Name: 2-[[2-[acetyl-(phenylmethyl)amino]-3,3-dimethyl-1-sulfanylidenebutyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[2-[acetyl(benzyl)amino]-3,3-dimethylbutanethioyl]amino]acetate Traditional Name: 2-[[2-[acetyl(benzyl)amino]-3,3-dimethyl-butanethioyl]amino]acetic acid ethyl ester Formula: C19H28N2O3S MolecularWeight: 364.50222

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC(=S)C(C(C)(C)C)N(CC1=CC=CC=C1)C(=O)C

Isomeric SMILES

CCOC(=O)CNC(=S)C(C(C)(C)C)N(CC1=CC=CC=C1)C(=O)C

InChI

InChI=1S/C19H28N2O3S/c1-6-24-16(23)12-20-18(25)17(19(3,4)5)21(14(2)22)13-15-10-8-7-9-11-15/h7-11,17H,6,12-13H2,1-5H3,(H,20,25)