N-methyl-3-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-[(1-phenylpyrazol-4-yl)methyl]propanamide

Systemtic Name: N-methyl-3-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-[(1-phenylpyrazol-4-yl)methyl]propanamide Openeye Name: N-methyl-3-[3-(m-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]-N-[(1-phenylpyrazol-4-yl)methyl]propanamide CAS Name: N-methyl-3-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-[(1-phenyl-4-pyrazolyl)methyl]propanamide IUPAC Name: N-methyl-3-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-[(1-phenylpyrazol-4-yl)methyl]propanamide Traditional Name: N-methyl-3-[3-(m-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]-N-[(1-phenylpyrazol-4-yl)methyl]propionamide Formula: C23H24N6OS MolecularWeight: 432.54126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NNC(=S)N2CCC(=O)N(C)CC3=CN(N=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC(=C1)C2=NNC(=S)N2CCC(=O)N(C)CC3=CN(N=C3)C4=CC=CC=C4

InChI

InChI=1S/C23H24N6OS/c1-17-7-6-8-19(13-17)22-25-26-23(31)28(22)12-11-21(30)27(2)15-18-14-24-29(16-18)20-9-4-3-5-10-20/h3-10,13-14,16H,11-12,15H2,1-2H3,(H,26,31)