3-[1-[(4-chlorophenyl)methyl]pyrazol-3-yl]-5-ethyl-6-methyl-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-[1-[(4-chlorophenyl)methyl]pyrazol-3-yl]-5-ethyl-6-methyl-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-[1-[(4-chlorophenyl)methyl]pyrazol-3-yl]-5-ethyl-6-methyl-2-thioxo-1H-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-[1-[(4-chlorophenyl)methyl]-3-pyrazolyl]-5-ethyl-6-methyl-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 3-[1-[(4-chlorophenyl)methyl]pyrazol-3-yl]-5-ethyl-6-methyl-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-[1-(4-chlorobenzyl)pyrazol-3-yl]-5-ethyl-6-methyl-2-thioxo-1H-thieno[2,3-d]pyrimidin-4-one Formula: C19H17ClN4OS2 MolecularWeight: 416.94748

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC2=C1C(=O)N(C(=S)N2)C3=NN(C=C3)CC4=CC=C(C=C4)Cl)C

Isomeric SMILES

CCC1=C(SC2=C1C(=O)N(C(=S)N2)C3=NN(C=C3)CC4=CC=C(C=C4)Cl)C

InChI

InChI=1S/C19H17ClN4OS2/c1-3-14-11(2)27-17-16(14)18(25)24(19(26)21-17)15-8-9-23(22-15)10-12-4-6-13(20)7-5-12/h4-9H,3,10H2,1-2H3,(H,21,26)