3-(4-tert-butylphenyl)-4-(4-methylphenyl)-5-(naphthalen-1-ylmethylsulfanyl)-1,2,4-triazole

Systemtic Name: 3-(4-tert-butylphenyl)-4-(4-methylphenyl)-5-(naphthalen-1-ylmethylsulfanyl)-1,2,4-triazole Openeye Name: 3-(4-tert-butylphenyl)-5-(1-naphthylmethylsulfanyl)-4-(p-tolyl)-1,2,4-triazole CAS Name: 3-(4-tert-butylphenyl)-4-(4-methylphenyl)-5-(1-naphthalenylmethylthio)-1,2,4-triazole IUPAC Name: 3-(4-tert-butylphenyl)-4-(4-methylphenyl)-5-(naphthalen-1-ylmethylsulfanyl)-1,2,4-triazole Traditional Name: 3-(4-tert-butylphenyl)-5-(1-naphthylmethylthio)-4-(p-tolyl)-1,2,4-triazole Formula: C30H29N3S MolecularWeight: 463.63636

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=CC4=CC=CC=C43)C5=CC=C(C=C5)C(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=CC4=CC=CC=C43)C5=CC=C(C=C5)C(C)(C)C

InChI

InChI=1S/C30H29N3S/c1-21-12-18-26(19-13-21)33-28(23-14-16-25(17-15-23)30(2,3)4)31-32-29(33)34-20-24-10-7-9-22-8-5-6-11-27(22)24/h5-19H,20H2,1-4H3