2-[4-methyl-5-(4-oxidanylcyclohexyl)imino-1,3,4-thiadiazol-2-yl]benzenecarbonitrile

Systemtic Name: 2-[4-methyl-5-(4-oxidanylcyclohexyl)imino-1,3,4-thiadiazol-2-yl]benzenecarbonitrile Openeye Name: 2-[5-(4-hydroxycyclohexyl)imino-4-methyl-1,3,4-thiadiazol-2-yl]benzonitrile CAS Name: 2-[5-(4-hydroxycyclohexyl)imino-4-methyl-1,3,4-thiadiazol-2-yl]benzonitrile IUPAC Name: 2-[5-(4-hydroxycyclohexyl)imino-4-methyl-1,3,4-thiadiazol-2-yl]benzonitrile Traditional Name: 2-[5-(4-hydroxycyclohexyl)imino-4-methyl-1,3,4-thiadiazol-2-yl]benzonitrile Formula: C16H18N4OS MolecularWeight: 314.40532

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC2CCC(CC2)O)SC(=N1)C3=CC=CC=C3C#N

Isomeric SMILES

CN1C(=NC2CCC(CC2)O)SC(=N1)C3=CC=CC=C3C#N

InChI

InChI=1S/C16H18N4OS/c1-20-16(18-12-6-8-13(21)9-7-12)22-15(19-20)14-5-3-2-4-11(14)10-17/h2-5,12-13,21H,6-9H2,1H3