methyl 3-[(5-chloranyl-2-methylsulfanyl-pyrimidin-4-yl)carbonylamino]-4-methyl-benzoate

Systemtic Name: methyl 3-[(5-chloranyl-2-methylsulfanyl-pyrimidin-4-yl)carbonylamino]-4-methyl-benzoate Openeye Name: methyl 3-[(5-chloro-2-methylsulfanyl-pyrimidine-4-carbonyl)amino]-4-methyl-benzoate CAS Name: 3-[[[5-chloro-2-(methylthio)-4-pyrimidinyl]-oxomethyl]amino]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[(5-chloro-2-methylsulfanylpyrimidine-4-carbonyl)amino]-4-methylbenzoate Traditional Name: 3-[[5-chloro-2-(methylthio)pyrimidine-4-carbonyl]amino]-4-methyl-benzoic acid methyl ester Formula: C15H14ClN3O3S MolecularWeight: 351.80796

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)C2=NC(=NC=C2Cl)SC

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)C2=NC(=NC=C2Cl)SC

InChI

InChI=1S/C15H14ClN3O3S/c1-8-4-5-9(14(21)22-2)6-11(8)18-13(20)12-10(16)7-17-15(19-12)23-3/h4-7H,1-3H3,(H,18,20)