3-thiophen-2-ylpropyl 4-(ethylcarbamoyloxymethyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: 3-thiophen-2-ylpropyl 4-(ethylcarbamoyloxymethyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: 3-(2-thienyl)propyl 4-(ethylcarbamoyloxymethyl)-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 4-(ethylcarbamoyloxymethyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylic acid 3-thiophen-2-ylpropyl ester IUPAC Name: 3-thiophen-2-ylpropyl 4-(ethylcarbamoyloxymethyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 4-(ethylcarbamoyloxymethyl)-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid 3-(2-thienyl)propyl ester Formula: C17H23N3O4S2 MolecularWeight: 397.51222

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)OCC1C(=C(NC(=S)N1)C)C(=O)OCCCC2=CC=CS2

Isomeric SMILES

CCNC(=O)OCC1C(=C(NC(=S)N1)C)C(=O)OCCCC2=CC=CS2

InChI

InChI=1S/C17H23N3O4S2/c1-3-18-17(22)24-10-13-14(11(2)19-16(25)20-13)15(21)23-8-4-6-12-7-5-9-26-12/h5,7,9,13H,3-4,6,8,10H2,1-2H3,(H,18,22)(H2,19,20,25)