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

Systemtic Name: 2-(2-oxidanylidenecyclohexyl)sulfanyl-3-phenyl-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-(2-oxocyclohexyl)sulfanyl-3-phenyl-5-(2-thienyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[(2-oxocyclohexyl)thio]-3-phenyl-5-thiophen-2-yl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-(2-oxocyclohexyl)sulfanyl-3-phenyl-5-thiophen-2-ylthieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[(2-ketocyclohexyl)thio]-3-phenyl-5-(2-thienyl)thieno[2,3-d]pyrimidin-4-one Formula: C22H18N2O2S3 MolecularWeight: 438.58552

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)C(C1)SC2=NC3=C(C(=CS3)C4=CC=CS4)C(=O)N2C5=CC=CC=C5

Isomeric SMILES

C1CCC(=O)C(C1)SC2=NC3=C(C(=CS3)C4=CC=CS4)C(=O)N2C5=CC=CC=C5

InChI

InChI=1S/C22H18N2O2S3/c25-16-9-4-5-10-18(16)29-22-23-20-19(15(13-28-20)17-11-6-12-27-17)21(26)24(22)14-7-2-1-3-8-14/h1-3,6-8,11-13,18H,4-5,9-10H2