4-[4-cyclopropyl-5-[(2-methylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]pyridine

Systemtic Name: 4-[4-cyclopropyl-5-[(2-methylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]pyridine Openeye Name: 4-[4-cyclopropyl-5-(o-tolylmethylsulfanyl)-1,2,4-triazol-3-yl]pyridine CAS Name: 4-[4-cyclopropyl-5-[(2-methylphenyl)methylthio]-1,2,4-triazol-3-yl]pyridine IUPAC Name: 4-[4-cyclopropyl-5-[(2-methylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]pyridine Traditional Name: 4-[4-cyclopropyl-5-[(2-methylbenzyl)thio]-1,2,4-triazol-3-yl]pyridine Formula: C18H18N4S MolecularWeight: 322.42732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSC2=NN=C(N2C3CC3)C4=CC=NC=C4

Isomeric SMILES

CC1=CC=CC=C1CSC2=NN=C(N2C3CC3)C4=CC=NC=C4

InChI

InChI=1S/C18H18N4S/c1-13-4-2-3-5-15(13)12-23-18-21-20-17(22(18)16-6-7-16)14-8-10-19-11-9-14/h2-5,8-11,16H,6-7,12H2,1H3