(3S,6S)-2-azanylidene-4-cyclopropyl-6-thiophen-2-yl-cyclohex-4-ene-1,1,3-tricarbonitrile

Systemtic Name: (3S,6S)-2-azanylidene-4-cyclopropyl-6-thiophen-2-yl-cyclohex-4-ene-1,1,3-tricarbonitrile Openeye Name: (3S,6S)-4-cyclopropyl-2-imino-6-(2-thienyl)cyclohex-4-ene-1,1,3-tricarbonitrile CAS Name: (3S,6S)-4-cyclopropyl-2-imino-6-thiophen-2-ylcyclohex-4-ene-1,1,3-tricarbonitrile IUPAC Name: (3S,6S)-4-cyclopropyl-2-imino-6-thiophen-2-ylcyclohex-4-ene-1,1,3-tricarbonitrile Traditional Name: (3S,6S)-4-cyclopropyl-2-imino-6-(2-thienyl)cyclohex-4-ene-1,1,3-tricarbonitrile Formula: C16H12N4S MolecularWeight: 292.35828

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=CC(C(C(=N)C2C#N)(C#N)C#N)C3=CC=CS3

Isomeric SMILES

C1CC1C2=C[C@@H](C(C(=N)[C@H]2C#N)(C#N)C#N)C3=CC=CS3

InChI

InChI=1S/C16H12N4S/c17-7-12-11(10-3-4-10)6-13(14-2-1-5-21-14)16(8-18,9-19)15(12)20/h1-2,5-6,10,12-13,20H,3-4H2/t12-,13+/m0/s1