N-[5-(4-ethylphenyl)-2-phenyl-pyrazol-3-yl]-2-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-[5-(4-ethylphenyl)-2-phenyl-pyrazol-3-yl]-2-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: 2-[(4-allyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-[5-(4-ethylphenyl)-2-phenyl-pyrazol-3-yl]acetamide CAS Name: N-[5-(4-ethylphenyl)-2-phenyl-3-pyrazolyl]-2-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-[5-(4-ethylphenyl)-2-phenylpyrazol-3-yl]-2-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: 2-[(4-allyl-5-methyl-1,2,4-triazol-3-yl)thio]-N-[5-(4-ethylphenyl)-2-phenyl-pyrazol-3-yl]acetamide Formula: C25H26N6OS MolecularWeight: 458.57854

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NN(C(=C2)NC(=O)CSC3=NN=C(N3CC=C)C)C4=CC=CC=C4

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NN(C(=C2)NC(=O)CSC3=NN=C(N3CC=C)C)C4=CC=CC=C4

InChI

InChI=1S/C25H26N6OS/c1-4-15-30-18(3)27-28-25(30)33-17-24(32)26-23-16-22(20-13-11-19(5-2)12-14-20)29-31(23)21-9-7-6-8-10-21/h4,6-14,16H,1,5,15,17H2,2-3H3,(H,26,32)