3-methyl-2-(4-oxidanylidene-4-phenyl-butyl)sulfanyl-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-methyl-2-(4-oxidanylidene-4-phenyl-butyl)sulfanyl-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-methyl-2-(4-oxo-4-phenyl-butyl)sulfanyl-5-(2-thienyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 3-methyl-2-[(4-oxo-4-phenylbutyl)thio]-5-thiophen-2-yl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-methyl-2-(4-oxo-4-phenylbutyl)sulfanyl-5-thiophen-2-ylthieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[(4-keto-4-phenyl-butyl)thio]-3-methyl-5-(2-thienyl)thieno[2,3-d]pyrimidin-4-one Formula: C21H18N2O2S3 MolecularWeight: 426.57482

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(N=C1SCCCC(=O)C3=CC=CC=C3)SC=C2C4=CC=CS4

Isomeric SMILES

CN1C(=O)C2=C(N=C1SCCCC(=O)C3=CC=CC=C3)SC=C2C4=CC=CS4

InChI

InChI=1S/C21H18N2O2S3/c1-23-20(25)18-15(17-10-6-11-26-17)13-28-19(18)22-21(23)27-12-5-9-16(24)14-7-3-2-4-8-14/h2-4,6-8,10-11,13H,5,9,12H2,1H3