methyl 4-(4-methoxyphenyl)-2-[2-(4-methylpyrimidin-2-yl)sulfanylethanoylamino]thiophene-3-carboxylate

Systemtic Name: methyl 4-(4-methoxyphenyl)-2-[2-(4-methylpyrimidin-2-yl)sulfanylethanoylamino]thiophene-3-carboxylate Openeye Name: methyl 4-(4-methoxyphenyl)-2-[[2-(4-methylpyrimidin-2-yl)sulfanylacetyl]amino]thiophene-3-carboxylate CAS Name: 4-(4-methoxyphenyl)-2-[[2-[(4-methyl-2-pyrimidinyl)thio]-1-oxoethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-(4-methoxyphenyl)-2-[[2-(4-methylpyrimidin-2-yl)sulfanylacetyl]amino]thiophene-3-carboxylate Traditional Name: 4-(4-methoxyphenyl)-2-[[2-[(4-methylpyrimidin-2-yl)thio]acetyl]amino]thiophene-3-carboxylic acid methyl ester Formula: C20H19N3O4S2 MolecularWeight: 429.51256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1)SCC(=O)NC2=C(C(=CS2)C3=CC=C(C=C3)OC)C(=O)OC

Isomeric SMILES

CC1=NC(=NC=C1)SCC(=O)NC2=C(C(=CS2)C3=CC=C(C=C3)OC)C(=O)OC

InChI

InChI=1S/C20H19N3O4S2/c1-12-8-9-21-20(22-12)29-11-16(24)23-18-17(19(25)27-3)15(10-28-18)13-4-6-14(26-2)7-5-13/h4-10H,11H2,1-3H3,(H,23,24)