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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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