ethyl 4,5-dimethyl-2-[2-(2-methyl-6-phenyl-pyrimidin-4-yl)sulfanylbutanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4,5-dimethyl-2-[2-(2-methyl-6-phenyl-pyrimidin-4-yl)sulfanylbutanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 4,5-dimethyl-2-[2-(2-methyl-6-phenyl-pyrimidin-4-yl)sulfanylbutanoylamino]thiophene-3-carboxylate CAS Name: 4,5-dimethyl-2-[[2-[(2-methyl-6-phenyl-4-pyrimidinyl)thio]-1-oxobutyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4,5-dimethyl-2-[2-(2-methyl-6-phenylpyrimidin-4-yl)sulfanylbutanoylamino]thiophene-3-carboxylate Traditional Name: 4,5-dimethyl-2-[2-[(2-methyl-6-phenyl-pyrimidin-4-yl)thio]butanoylamino]thiophene-3-carboxylic acid ethyl ester Formula: C24H27N3O3S2 MolecularWeight: 469.61948

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(C(=C(S1)C)C)C(=O)OCC)SC2=NC(=NC(=C2)C3=CC=CC=C3)C

Isomeric SMILES

CCC(C(=O)NC1=C(C(=C(S1)C)C)C(=O)OCC)SC2=NC(=NC(=C2)C3=CC=CC=C3)C

InChI

InChI=1S/C24H27N3O3S2/c1-6-19(22(28)27-23-21(24(29)30-7-2)14(3)15(4)31-23)32-20-13-18(25-16(5)26-20)17-11-9-8-10-12-17/h8-13,19H,6-7H2,1-5H3,(H,27,28)