ethyl 4-[(4-methyl-6-methylsulfanyl-2-propan-2-yl-pyrimidin-5-yl)carbonylamino]benzoate

Systemtic Name: ethyl 4-[(4-methyl-6-methylsulfanyl-2-propan-2-yl-pyrimidin-5-yl)carbonylamino]benzoate Openeye Name: ethyl 4-[(2-isopropyl-4-methyl-6-methylsulfanyl-pyrimidine-5-carbonyl)amino]benzoate CAS Name: 4-[[[4-methyl-6-(methylthio)-2-propan-2-yl-5-pyrimidinyl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(4-methyl-6-methylsulfanyl-2-propan-2-ylpyrimidine-5-carbonyl)amino]benzoate Traditional Name: 4-[[2-isopropyl-4-methyl-6-(methylthio)pyrimidine-5-carbonyl]amino]benzoic acid ethyl ester Formula: C19H23N3O3S MolecularWeight: 373.46922

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(N=C(N=C2SC)C(C)C)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(N=C(N=C2SC)C(C)C)C

InChI

InChI=1S/C19H23N3O3S/c1-6-25-19(24)13-7-9-14(10-8-13)21-17(23)15-12(4)20-16(11(2)3)22-18(15)26-5/h7-11H,6H2,1-5H3,(H,21,23)