4-(5-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylbutanenitrile

Systemtic Name: 4-(5-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylbutanenitrile Openeye Name: 4-(5-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylbutanenitrile CAS Name: 4-[(5-phenyl-4-thieno[2,3-d]pyrimidinyl)thio]butanenitrile IUPAC Name: 4-(5-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylbutanenitrile Traditional Name: 4-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)thio]butyronitrile Formula: C16H13N3S2 MolecularWeight: 311.42452

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CSC3=C2C(=NC=N3)SCCCC#N

Isomeric SMILES

C1=CC=C(C=C1)C2=CSC3=C2C(=NC=N3)SCCCC#N

InChI

InChI=1S/C16H13N3S2/c17-8-4-5-9-20-15-14-13(12-6-2-1-3-7-12)10-21-16(14)19-11-18-15/h1-3,6-7,10-11H,4-5,9H2