methyl 2-[[5-(2-methylphenyl)-1,2,3,6-tetrahydropyridin-4-yl]carbonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: methyl 2-[[5-(2-methylphenyl)-1,2,3,6-tetrahydropyridin-4-yl]carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: methyl 4-methylsulfanyl-2-[[5-(o-tolyl)-1,2,3,6-tetrahydropyridine-4-carbonyl]amino]butanoate CAS Name: 2-[[[5-(2-methylphenyl)-1,2,3,6-tetrahydropyridin-4-yl]-oxomethyl]amino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl 2-[[5-(2-methylphenyl)-1,2,3,6-tetrahydropyridine-4-carbonyl]amino]-4-methylsulfanylbutanoate Traditional Name: 4-(methylthio)-2-[[5-(o-tolyl)-1,2,3,6-tetrahydropyridine-4-carbonyl]amino]butyric acid methyl ester Formula: C19H26N2O3S MolecularWeight: 362.48634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=C(CCNC2)C(=O)NC(CCSC)C(=O)OC

Isomeric SMILES

CC1=CC=CC=C1C2=C(CCNC2)C(=O)NC(CCSC)C(=O)OC

InChI

InChI=1S/C19H26N2O3S/c1-13-6-4-5-7-14(13)16-12-20-10-8-15(16)18(22)21-17(9-11-25-3)19(23)24-2/h4-7,17,20H,8-12H2,1-3H3,(H,21,22)