3-[5-(4-chlorophenyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]propanenitrile

Systemtic Name: 3-[5-(4-chlorophenyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]propanenitrile Openeye Name: 3-[5-(4-chlorophenyl)-4-oxo-thieno[2,3-d]pyrimidin-3-yl]propanenitrile CAS Name: 3-[5-(4-chlorophenyl)-4-oxo-3-thieno[2,3-d]pyrimidinyl]propanenitrile IUPAC Name: 3-[5-(4-chlorophenyl)-4-oxothieno[2,3-d]pyrimidin-3-yl]propanenitrile Traditional Name: 3-[5-(4-chlorophenyl)-4-keto-thieno[2,3-d]pyrimidin-3-yl]propionitrile Formula: C15H10ClN3OS MolecularWeight: 315.7774

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CSC3=C2C(=O)N(C=N3)CCC#N)Cl

Isomeric SMILES

C1=CC(=CC=C1C2=CSC3=C2C(=O)N(C=N3)CCC#N)Cl

InChI

InChI=1S/C15H10ClN3OS/c16-11-4-2-10(3-5-11)12-8-21-14-13(12)15(20)19(9-18-14)7-1-6-17/h2-5,8-9H,1,7H2