methyl 2-[[2-(2-methylphenyl)-4-(thiophen-2-ylmethoxymethyl)phenyl]carbonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: methyl 2-[[2-(2-methylphenyl)-4-(thiophen-2-ylmethoxymethyl)phenyl]carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: methyl 4-methylsulfanyl-2-[[2-(o-tolyl)-4-(2-thienylmethoxymethyl)benzoyl]amino]butanoate CAS Name: 2-[[[2-(2-methylphenyl)-4-(thiophen-2-ylmethoxymethyl)phenyl]-oxomethyl]amino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl 2-[[2-(2-methylphenyl)-4-(thiophen-2-ylmethoxymethyl)benzoyl]amino]-4-methylsulfanylbutanoate Traditional Name: 4-(methylthio)-2-[[2-(o-tolyl)-4-(2-thenyloxymethyl)benzoyl]amino]butyric acid methyl ester Formula: C26H29NO4S2 MolecularWeight: 483.64276

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=C(C=CC(=C2)COCC3=CC=CS3)C(=O)NC(CCSC)C(=O)OC

Isomeric SMILES

CC1=CC=CC=C1C2=C(C=CC(=C2)COCC3=CC=CS3)C(=O)NC(CCSC)C(=O)OC

InChI

InChI=1S/C26H29NO4S2/c1-18-7-4-5-9-21(18)23-15-19(16-31-17-20-8-6-13-33-20)10-11-22(23)25(28)27-24(12-14-32-3)26(29)30-2/h4-11,13,15,24H,12,14,16-17H2,1-3H3,(H,27,28)