2-[(9-oxidanylidene-3-phenyl-5,6,7,8-tetrahydrothiochromeno[2,3-d]imidazol-2-yl)sulfanyl]ethanenitrile

Systemtic Name: 2-[(9-oxidanylidene-3-phenyl-5,6,7,8-tetrahydrothiochromeno[2,3-d]imidazol-2-yl)sulfanyl]ethanenitrile Openeye Name: 2-[(9-oxo-3-phenyl-5,6,7,8-tetrahydrothiochromeno[2,3-d]imidazol-2-yl)sulfanyl]acetonitrile CAS Name: 2-[(9-oxo-3-phenyl-5,6,7,8-tetrahydrothiochromeno[2,3-d]imidazol-2-yl)thio]acetonitrile IUPAC Name: 2-[(9-oxo-3-phenyl-5,6,7,8-tetrahydrothiochromeno[2,3-d]imidazol-2-yl)sulfanyl]acetonitrile Traditional Name: 2-[(9-keto-3-phenyl-5,6,7,8-tetrahydrothiochromen[2,3-d]imidazol-2-yl)thio]acetonitrile Formula: C18H15N3OS2 MolecularWeight: 353.4612

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=O)C3=C(S2)N(C(=N3)SCC#N)C4=CC=CC=C4

Isomeric SMILES

C1CCC2=C(C1)C(=O)C3=C(S2)N(C(=N3)SCC#N)C4=CC=CC=C4

InChI

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