2-[(3-cyclopentyl-4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanylmethyl]benzenecarbonitrile

Systemtic Name: 2-[(3-cyclopentyl-4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanylmethyl]benzenecarbonitrile Openeye Name: 2-[(3-cyclopentyl-4-oxo-5-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanylmethyl]benzonitrile CAS Name: 2-[[(3-cyclopentyl-4-oxo-5-phenyl-2-thieno[2,3-d]pyrimidinyl)thio]methyl]benzonitrile IUPAC Name: 2-[(3-cyclopentyl-4-oxo-5-phenylthieno[2,3-d]pyrimidin-2-yl)sulfanylmethyl]benzonitrile Traditional Name: 2-[[(3-cyclopentyl-4-keto-5-phenyl-thieno[2,3-d]pyrimidin-2-yl)thio]methyl]benzonitrile Formula: C25H21N3OS2 MolecularWeight: 443.58374

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C(=O)C3=C(N=C2SCC4=CC=CC=C4C#N)SC=C3C5=CC=CC=C5

Isomeric SMILES

C1CCC(C1)N2C(=O)C3=C(N=C2SCC4=CC=CC=C4C#N)SC=C3C5=CC=CC=C5

InChI

InChI=1S/C25H21N3OS2/c26-14-18-10-4-5-11-19(18)15-31-25-27-23-22(24(29)28(25)20-12-6-7-13-20)21(16-30-23)17-8-2-1-3-9-17/h1-5,8-11,16,20H,6-7,12-13,15H2