O-ethyl [2-[[(E)-2-methyl-3-phenylsulfanyl-prop-1-enyl]-(phenylmethyl)amino]-2-oxidanylidene-ethyl]sulfanylmethanethioate

Systemtic Name: O-ethyl [2-[[(E)-2-methyl-3-phenylsulfanyl-prop-1-enyl]-(phenylmethyl)amino]-2-oxidanylidene-ethyl]sulfanylmethanethioate Openeye Name: O-ethyl [2-[benzyl-[(E)-2-methyl-3-phenylsulfanyl-prop-1-enyl]amino]-2-oxo-ethyl]sulfanylmethanethioate CAS Name: [[2-[[(E)-2-methyl-3-(phenylthio)prop-1-enyl]-(phenylmethyl)amino]-2-oxoethyl]thio]methanethioic acid O-ethyl ester IUPAC Name: O-ethyl [2-[benzyl-[(E)-2-methyl-3-phenylsulfanylprop-1-enyl]amino]-2-oxoethyl]sulfanylmethanethioate Traditional Name: [[2-[benzyl-[(E)-2-methyl-3-(phenylthio)prop-1-enyl]amino]-2-keto-ethyl]thio]methanethioic acid O-ethyl ester Formula: C22H25NO2S3 MolecularWeight: 431.6344

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=S)SCC(=O)N(CC1=CC=CC=C1)C=C(C)CSC2=CC=CC=C2

Isomeric SMILES

CCOC(=S)SCC(=O)N(CC1=CC=CC=C1)/C=C(\C)/CSC2=CC=CC=C2

InChI

InChI=1S/C22H25NO2S3/c1-3-25-22(26)28-17-21(24)23(15-19-10-6-4-7-11-19)14-18(2)16-27-20-12-8-5-9-13-20/h4-14H,3,15-17H2,1-2H3/b18-14+