5-(4-methylphenyl)-2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-3-phenyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-(4-methylphenyl)-2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-3-phenyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[2-oxo-2-(1-piperidyl)ethyl]sulfanyl-3-phenyl-5-(p-tolyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 5-(4-methylphenyl)-2-[[2-oxo-2-(1-piperidinyl)ethyl]thio]-3-phenyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 5-(4-methylphenyl)-2-(2-oxo-2-piperidin-1-ylethyl)sulfanyl-3-phenylthieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[(2-keto-2-piperidino-ethyl)thio]-3-phenyl-5-(p-tolyl)thieno[2,3-d]pyrimidin-4-one Formula: C26H25N3O2S2 MolecularWeight: 475.6256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C(=N3)SCC(=O)N4CCCCC4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C(=N3)SCC(=O)N4CCCCC4)C5=CC=CC=C5

InChI

InChI=1S/C26H25N3O2S2/c1-18-10-12-19(13-11-18)21-16-32-24-23(21)25(31)29(20-8-4-2-5-9-20)26(27-24)33-17-22(30)28-14-6-3-7-15-28/h2,4-5,8-13,16H,3,6-7,14-15,17H2,1H3