ethyl 4-(furan-2-yl)-2-[2-(4-methylpyrimidin-2-yl)sulfanylethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-(furan-2-yl)-2-[2-(4-methylpyrimidin-2-yl)sulfanylethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-(2-furyl)-2-[[2-(4-methylpyrimidin-2-yl)sulfanylacetyl]amino]thiophene-3-carboxylate CAS Name: 4-(2-furanyl)-2-[[2-[(4-methyl-2-pyrimidinyl)thio]-1-oxoethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(furan-2-yl)-2-[[2-(4-methylpyrimidin-2-yl)sulfanylacetyl]amino]thiophene-3-carboxylate Traditional Name: 4-(2-furyl)-2-[[2-[(4-methylpyrimidin-2-yl)thio]acetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C18H17N3O4S2 MolecularWeight: 403.47528

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=CO2)NC(=O)CSC3=NC=CC(=N3)C

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=CO2)NC(=O)CSC3=NC=CC(=N3)C

InChI

InChI=1S/C18H17N3O4S2/c1-3-24-17(23)15-12(13-5-4-8-25-13)9-26-16(15)21-14(22)10-27-18-19-7-6-11(2)20-18/h4-9H,3,10H2,1-2H3,(H,21,22)