methyl 3-[3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)propanoylamino]-4-methyl-benzoate

Systemtic Name: methyl 3-[3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)propanoylamino]-4-methyl-benzoate Openeye Name: methyl 3-[3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)propanoylamino]-4-methyl-benzoate CAS Name: 3-[[3-[4,6-dimethyl-2-(methylthio)-5-pyrimidinyl]-1-oxopropyl]amino]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)propanoylamino]-4-methylbenzoate Traditional Name: 3-[3-[4,6-dimethyl-2-(methylthio)pyrimidin-5-yl]propanoylamino]-4-methyl-benzoic acid methyl ester Formula: C19H23N3O3S MolecularWeight: 373.46922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CCC2=C(N=C(N=C2C)SC)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CCC2=C(N=C(N=C2C)SC)C

InChI

InChI=1S/C19H23N3O3S/c1-11-6-7-14(18(24)25-4)10-16(11)22-17(23)9-8-15-12(2)20-19(26-5)21-13(15)3/h6-7,10H,8-9H2,1-5H3,(H,22,23)