methyl 4-methyl-3-[(4-methyl-6-methylsulfanyl-2-thiophen-2-yl-pyrimidin-5-yl)carbonylamino]benzoate

Systemtic Name: methyl 4-methyl-3-[(4-methyl-6-methylsulfanyl-2-thiophen-2-yl-pyrimidin-5-yl)carbonylamino]benzoate Openeye Name: methyl 4-methyl-3-[[4-methyl-6-methylsulfanyl-2-(2-thienyl)pyrimidine-5-carbonyl]amino]benzoate CAS Name: 4-methyl-3-[[[4-methyl-6-(methylthio)-2-thiophen-2-yl-5-pyrimidinyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-methyl-3-[(4-methyl-6-methylsulfanyl-2-thiophen-2-ylpyrimidine-5-carbonyl)amino]benzoate Traditional Name: 4-methyl-3-[[4-methyl-6-(methylthio)-2-(2-thienyl)pyrimidine-5-carbonyl]amino]benzoic acid methyl ester Formula: C20H19N3O3S2 MolecularWeight: 413.51316

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)C2=C(N=C(N=C2SC)C3=CC=CS3)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)C2=C(N=C(N=C2SC)C3=CC=CS3)C

InChI

InChI=1S/C20H19N3O3S2/c1-11-7-8-13(20(25)26-3)10-14(11)22-18(24)16-12(2)21-17(23-19(16)27-4)15-6-5-9-28-15/h5-10H,1-4H3,(H,22,24)