3-[(3-methylphenyl)methylsulfanyl]-5-phenethyl-1,2,4-triazol-4-amine

Systemtic Name: 3-[(3-methylphenyl)methylsulfanyl]-5-phenethyl-1,2,4-triazol-4-amine Openeye Name: 3-(m-tolylmethylsulfanyl)-5-phenethyl-1,2,4-triazol-4-amine CAS Name: 3-[(3-methylphenyl)methylthio]-5-phenethyl-1,2,4-triazol-4-amine IUPAC Name: 3-[(3-methylphenyl)methylsulfanyl]-5-phenethyl-1,2,4-triazol-4-amine Traditional Name: [3-[(3-methylbenzyl)thio]-5-phenethyl-1,2,4-triazol-4-yl]amine Formula: C18H20N4S MolecularWeight: 324.4432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CSC2=NN=C(N2N)CCC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=CC=C1)CSC2=NN=C(N2N)CCC3=CC=CC=C3

InChI

InChI=1S/C18H20N4S/c1-14-6-5-9-16(12-14)13-23-18-21-20-17(22(18)19)11-10-15-7-3-2-4-8-15/h2-9,12H,10-11,13,19H2,1H3