4-(2,4-dimethylphenyl)-3-(naphthalen-1-ylmethyl)-5-propylsulfanyl-1,2,4-triazole

Systemtic Name: 4-(2,4-dimethylphenyl)-3-(naphthalen-1-ylmethyl)-5-propylsulfanyl-1,2,4-triazole Openeye Name: 4-(2,4-dimethylphenyl)-3-(1-naphthylmethyl)-5-propylsulfanyl-1,2,4-triazole CAS Name: 4-(2,4-dimethylphenyl)-3-(1-naphthalenylmethyl)-5-(propylthio)-1,2,4-triazole IUPAC Name: 4-(2,4-dimethylphenyl)-3-(naphthalen-1-ylmethyl)-5-propylsulfanyl-1,2,4-triazole Traditional Name: 4-(2,4-dimethylphenyl)-3-(1-naphthylmethyl)-5-(propylthio)-1,2,4-triazole Formula: C24H25N3S MolecularWeight: 387.5404

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NN=C(N1C2=C(C=C(C=C2)C)C)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CCCSC1=NN=C(N1C2=C(C=C(C=C2)C)C)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C24H25N3S/c1-4-14-28-24-26-25-23(27(24)22-13-12-17(2)15-18(22)3)16-20-10-7-9-19-8-5-6-11-21(19)20/h5-13,15H,4,14,16H2,1-3H3