(5R,8S,8aR)-6-azanylidene-8-thiophen-2-yl-3,5,8,8a-tetrahydro-1H-isothiochromene-5,7,7-tricarbonitrile

Systemtic Name: (5R,8S,8aR)-6-azanylidene-8-thiophen-2-yl-3,5,8,8a-tetrahydro-1H-isothiochromene-5,7,7-tricarbonitrile Openeye Name: (5R,8S,8aR)-6-imino-8-(2-thienyl)-3,5,8,8a-tetrahydro-1H-isothiochromene-5,7,7-tricarbonitrile CAS Name: (5R,8S,8aR)-6-imino-8-thiophen-2-yl-3,5,8,8a-tetrahydro-1H-2-benzothiopyran-5,7,7-tricarbonitrile IUPAC Name: (5R,8S,8aR)-6-imino-8-thiophen-2-yl-3,5,8,8a-tetrahydro-1H-isothiochromene-5,7,7-tricarbonitrile Traditional Name: (5R,8S,8aR)-6-imino-8-(2-thienyl)-3,5,8,8a-tetrahydro-1H-isothiochromene-5,7,7-tricarbonitrile Formula: C16H12N4S2 MolecularWeight: 324.42328

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Descriptors Computed from Structure

Canonical SMILES:

C1C=C2C(CS1)C(C(C(=N)C2C#N)(C#N)C#N)C3=CC=CS3

Isomeric SMILES

C1C=C2[C@H](CS1)[C@@H](C(C(=N)[C@@H]2C#N)(C#N)C#N)C3=CC=CS3

InChI

InChI=1S/C16H12N4S2/c17-6-11-10-3-5-21-7-12(10)14(13-2-1-4-22-13)16(8-18,9-19)15(11)20/h1-4,11-12,14,20H,5,7H2/t11-,12+,14-/m1/s1