methyl (2R)-2-[2-[4-(4-methylphenyl)-2-sulfanylidene-1,3-thiazol-3-yl]ethanoylamino]-4-methylsulfanyl-butanoate

Systemtic Name: methyl (2R)-2-[2-[4-(4-methylphenyl)-2-sulfanylidene-1,3-thiazol-3-yl]ethanoylamino]-4-methylsulfanyl-butanoate Openeye Name: methyl (2R)-4-methylsulfanyl-2-[[2-[4-(p-tolyl)-2-thioxo-thiazol-3-yl]acetyl]amino]butanoate CAS Name: (2R)-2-[[2-[4-(4-methylphenyl)-2-sulfanylidene-3-thiazolyl]-1-oxoethyl]amino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl (2R)-2-[[2-[4-(4-methylphenyl)-2-sulfanylidene-1,3-thiazol-3-yl]acetyl]amino]-4-methylsulfanylbutanoate Traditional Name: (2R)-4-(methylthio)-2-[[2-[4-(p-tolyl)-2-thioxo-4-thiazolin-3-yl]acetyl]amino]butyric acid methyl ester Formula: C18H22N2O3S3 MolecularWeight: 410.57388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC(=S)N2CC(=O)NC(CCSC)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC(=S)N2CC(=O)N[C@H](CCSC)C(=O)OC

InChI

InChI=1S/C18H22N2O3S3/c1-12-4-6-13(7-5-12)15-11-26-18(24)20(15)10-16(21)19-14(8-9-25-3)17(22)23-2/h4-7,11,14H,8-10H2,1-3H3,(H,19,21)/t14-/m1/s1