6-azanyl-8-thiophen-2-yl-1,3,8,8a-tetrahydroisothiochromene-5,7,7-tricarbonitrile

Systemtic Name: 6-azanyl-8-thiophen-2-yl-1,3,8,8a-tetrahydroisothiochromene-5,7,7-tricarbonitrile Openeye Name: 6-amino-8-(2-thienyl)-1,3,8,8a-tetrahydroisothiochromene-5,7,7-tricarbonitrile CAS Name: 6-amino-8-thiophen-2-yl-1,3,8,8a-tetrahydro-2-benzothiopyran-5,7,7-tricarbonitrile IUPAC Name: 6-amino-8-thiophen-2-yl-1,3,8,8a-tetrahydroisothiochromene-5,7,7-tricarbonitrile Traditional Name: 6-amino-8-(2-thienyl)-1,3,8,8a-tetrahydroisothiochromene-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(=C2C#N)N)(C#N)C#N)C3=CC=CS3

Isomeric SMILES

C1C=C2C(CS1)C(C(C(=C2C#N)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/h1-4,12,14H,5,7,20H2