3-cyclohexyl-4-[(E)-[3-methoxy-4-(2-methylpropoxy)phenyl]methylideneamino]-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-cyclohexyl-4-[(E)-[3-methoxy-4-(2-methylpropoxy)phenyl]methylideneamino]-1H-1,2,4-triazole-5-thione Openeye Name: 3-cyclohexyl-4-[(E)-(4-isobutoxy-3-methoxy-phenyl)methyleneamino]-1H-1,2,4-triazole-5-thione CAS Name: 3-cyclohexyl-4-[(E)-[3-methoxy-4-(2-methylpropoxy)phenyl]methylideneamino]-1H-1,2,4-triazole-5-thione IUPAC Name: 3-cyclohexyl-4-[(E)-[3-methoxy-4-(2-methylpropoxy)phenyl]methylideneamino]-1H-1,2,4-triazole-5-thione Traditional Name: 3-cyclohexyl-4-[(E)-(4-isobutoxy-3-methoxy-benzylidene)amino]-1H-1,2,4-triazole-5-thione Formula: C20H28N4O2S MolecularWeight: 388.52692

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1)C=NN2C(=NNC2=S)C3CCCCC3)OC

Isomeric SMILES

CC(C)COC1=C(C=C(C=C1)/C=N/N2C(=NNC2=S)C3CCCCC3)OC

InChI

InChI=1S/C20H28N4O2S/c1-14(2)13-26-17-10-9-15(11-18(17)25-3)12-21-24-19(22-23-20(24)27)16-7-5-4-6-8-16/h9-12,14,16H,4-8,13H2,1-3H3,(H,23,27)/b21-12+