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

Systemtic Name: methyl 4,5-dimethyl-2-[2-(2-methyl-6-phenyl-pyrimidin-4-yl)sulfanylbutanoylamino]thiophene-3-carboxylate Openeye Name: methyl 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 methyl ester IUPAC Name: methyl 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 methyl ester Formula: C23H25N3O3S2 MolecularWeight: 455.5929

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H25N3O3S2/c1-6-18(21(27)26-22-20(23(28)29-5)13(2)14(3)30-22)31-19-12-17(24-15(4)25-19)16-10-8-7-9-11-16/h7-12,18H,6H2,1-5H3,(H,26,27)