3-(1,3-benzothiazol-2-yl)pentane-1,3,5-tricarbonitrile

Systemtic Name: 3-(1,3-benzothiazol-2-yl)pentane-1,3,5-tricarbonitrile Openeye Name: 3-(1,3-benzothiazol-2-yl)pentane-1,3,5-tricarbonitrile CAS Name: 3-(1,3-benzothiazol-2-yl)pentane-1,3,5-tricarbonitrile IUPAC Name: 3-(1,3-benzothiazol-2-yl)pentane-1,3,5-tricarbonitrile Traditional Name: 3-(1,3-benzothiazol-2-yl)pentane-1,3,5-tricarbonitrile Formula: C15H12N4S MolecularWeight: 280.34758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C(CCC#N)(CCC#N)C#N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C(CCC#N)(CCC#N)C#N

InChI

InChI=1S/C15H12N4S/c16-9-3-7-15(11-18,8-4-10-17)14-19-12-5-1-2-6-13(12)20-14/h1-2,5-6H,3-4,7-8H2