4-[(3-ethyl-4-oxidanylidene-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]butanenitrile

Systemtic Name: 4-[(3-ethyl-4-oxidanylidene-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]butanenitrile Openeye Name: 4-[(3-ethyl-4-oxo-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-2-yl)sulfanyl]butanenitrile CAS Name: 4-[(3-ethyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)thio]butanenitrile IUPAC Name: 4-[(3-ethyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]butanenitrile Traditional Name: 4-[(3-ethyl-4-keto-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-2-yl)thio]butyronitrile Formula: C16H19N3OS2 MolecularWeight: 333.47156

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(N=C1SCCCC#N)SC3=C2CCCC3

Isomeric SMILES

CCN1C(=O)C2=C(N=C1SCCCC#N)SC3=C2CCCC3

InChI

InChI=1S/C16H19N3OS2/c1-2-19-15(20)13-11-7-3-4-8-12(11)22-14(13)18-16(19)21-10-6-5-9-17/h2-8,10H2,1H3