4-methyl-3-[(4-methylphenyl)methylsulfanyl]-5-(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)-1,2,4-triazole

Systemtic Name: 4-methyl-3-[(4-methylphenyl)methylsulfanyl]-5-(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)-1,2,4-triazole Openeye Name: 4-methyl-3-(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)-5-(p-tolylmethylsulfanyl)-1,2,4-triazole CAS Name: 4-methyl-3-[(4-methylphenyl)methylthio]-5-[1-phenyl-5-(1-pyrrolyl)-4-pyrazolyl]-1,2,4-triazole IUPAC Name: 4-methyl-3-[(4-methylphenyl)methylsulfanyl]-5-(1-phenyl-5-pyrrol-1-ylpyrazol-4-yl)-1,2,4-triazole Traditional Name: 4-methyl-3-[(4-methylbenzyl)thio]-5-(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)-1,2,4-triazole Formula: C24H22N6S MolecularWeight: 426.53668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NN=C(N2C)C3=C(N(N=C3)C4=CC=CC=C4)N5C=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NN=C(N2C)C3=C(N(N=C3)C4=CC=CC=C4)N5C=CC=C5

InChI

InChI=1S/C24H22N6S/c1-18-10-12-19(13-11-18)17-31-24-27-26-22(28(24)2)21-16-25-30(20-8-4-3-5-9-20)23(21)29-14-6-7-15-29/h3-16H,17H2,1-2H3