(3-pyrrol-1-ylthiophen-2-yl)methyl 6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: (3-pyrrol-1-ylthiophen-2-yl)methyl 6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: (3-pyrrol-1-yl-2-thienyl)methyl 6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylic acid [3-(1-pyrrolyl)-2-thiophenyl]methyl ester IUPAC Name: (3-pyrrol-1-ylthiophen-2-yl)methyl 6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid (3-pyrrol-1-yl-2-thienyl)methyl ester Formula: C15H15N3O2S2 MolecularWeight: 333.4285

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CNC(=S)N1)C(=O)OCC2=C(C=CS2)N3C=CC=C3

Isomeric SMILES

CC1=C(CNC(=S)N1)C(=O)OCC2=C(C=CS2)N3C=CC=C3

InChI

InChI=1S/C15H15N3O2S2/c1-10-11(8-16-15(21)17-10)14(19)20-9-13-12(4-7-22-13)18-5-2-3-6-18/h2-7H,8-9H2,1H3,(H2,16,17,21)