3-(5-cyclopropyl-4-oxidanylidene-3-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanylpropanenitrile

Systemtic Name: 3-(5-cyclopropyl-4-oxidanylidene-3-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanylpropanenitrile Openeye Name: 3-(5-cyclopropyl-4-oxo-3-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanylpropanenitrile CAS Name: 3-[(5-cyclopropyl-4-oxo-3-phenyl-2-thieno[2,3-d]pyrimidinyl)thio]propanenitrile IUPAC Name: 3-(5-cyclopropyl-4-oxo-3-phenylthieno[2,3-d]pyrimidin-2-yl)sulfanylpropanenitrile Traditional Name: 3-[(5-cyclopropyl-4-keto-3-phenyl-thieno[2,3-d]pyrimidin-2-yl)thio]propionitrile Formula: C18H15N3OS2 MolecularWeight: 353.4612

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=CSC3=C2C(=O)N(C(=N3)SCCC#N)C4=CC=CC=C4

Isomeric SMILES

C1CC1C2=CSC3=C2C(=O)N(C(=N3)SCCC#N)C4=CC=CC=C4

InChI

InChI=1S/C18H15N3OS2/c19-9-4-10-23-18-20-16-15(14(11-24-16)12-7-8-12)17(22)21(18)13-5-2-1-3-6-13/h1-3,5-6,11-12H,4,7-8,10H2