4-(3-ethyl-4-oxidanylidene-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-2-yl)sulfanylbutanenitrile

Systemtic Name: 4-(3-ethyl-4-oxidanylidene-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-2-yl)sulfanylbutanenitrile Openeye Name: 4-[3-ethyl-4-oxo-5-(2-thienyl)thieno[2,3-d]pyrimidin-2-yl]sulfanylbutanenitrile CAS Name: 4-[(3-ethyl-4-oxo-5-thiophen-2-yl-2-thieno[2,3-d]pyrimidinyl)thio]butanenitrile IUPAC Name: 4-(3-ethyl-4-oxo-5-thiophen-2-ylthieno[2,3-d]pyrimidin-2-yl)sulfanylbutanenitrile Traditional Name: 4-[[3-ethyl-4-keto-5-(2-thienyl)thieno[2,3-d]pyrimidin-2-yl]thio]butyronitrile Formula: C16H15N3OS3 MolecularWeight: 361.5048

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(N=C1SCCCC#N)SC=C2C3=CC=CS3

Isomeric SMILES

CCN1C(=O)C2=C(N=C1SCCCC#N)SC=C2C3=CC=CS3

InChI

InChI=1S/C16H15N3OS3/c1-2-19-15(20)13-11(12-6-5-9-21-12)10-23-14(13)18-16(19)22-8-4-3-7-17/h5-6,9-10H,2-4,8H2,1H3