3-cyclohexyl-5-[(3-methylphenyl)methylsulfanyl]-4-phenyl-1,2,4-triazole

Systemtic Name: 3-cyclohexyl-5-[(3-methylphenyl)methylsulfanyl]-4-phenyl-1,2,4-triazole Openeye Name: 3-cyclohexyl-5-(m-tolylmethylsulfanyl)-4-phenyl-1,2,4-triazole CAS Name: 3-cyclohexyl-5-[(3-methylphenyl)methylthio]-4-phenyl-1,2,4-triazole IUPAC Name: 3-cyclohexyl-5-[(3-methylphenyl)methylsulfanyl]-4-phenyl-1,2,4-triazole Traditional Name: 3-cyclohexyl-5-[(3-methylbenzyl)thio]-4-phenyl-1,2,4-triazole Formula: C22H25N3S MolecularWeight: 363.519

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CSC2=NN=C(N2C3=CC=CC=C3)C4CCCCC4

Isomeric SMILES

CC1=CC(=CC=C1)CSC2=NN=C(N2C3=CC=CC=C3)C4CCCCC4

InChI

InChI=1S/C22H25N3S/c1-17-9-8-10-18(15-17)16-26-22-24-23-21(19-11-4-2-5-12-19)25(22)20-13-6-3-7-14-20/h3,6-10,13-15,19H,2,4-5,11-12,16H2,1H3