phenethyl 5-methyl-4-sulfanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: phenethyl 5-methyl-4-sulfanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: phenethyl 5-methyl-4-thioxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-sulfanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid phenethyl ester IUPAC Name: phenethyl 5-methyl-4-sulfanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 5-methyl-4-thioxo-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid phenethyl ester Formula: C16H14N2O2S2 MolecularWeight: 330.42456

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=S)NC=N2)C(=O)OCCC3=CC=CC=C3

Isomeric SMILES

CC1=C(SC2=C1C(=S)NC=N2)C(=O)OCCC3=CC=CC=C3

InChI

InChI=1S/C16H14N2O2S2/c1-10-12-14(21)17-9-18-15(12)22-13(10)16(19)20-8-7-11-5-3-2-4-6-11/h2-6,9H,7-8H2,1H3,(H,17,18,21)