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

Systemtic Name: N-[(1,3-diphenylpyrazol-4-yl)methyl]-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide Openeye Name: N-[(1,3-diphenylpyrazol-4-yl)methyl]-3-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propanamide CAS Name: N-[(1,3-diphenyl-4-pyrazolyl)methyl]-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide IUPAC Name: N-[(1,3-diphenylpyrazol-4-yl)methyl]-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide Traditional Name: N-[(1,3-diphenylpyrazol-4-yl)methyl]-3-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propionamide Formula: C25H22N6OS2 MolecularWeight: 486.61178

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C=C2CNC(=O)CCN3C(=NNC3=S)C4=CC=CS4)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C=C2CNC(=O)CCN3C(=NNC3=S)C4=CC=CS4)C5=CC=CC=C5

InChI

InChI=1S/C25H22N6OS2/c32-22(13-14-30-24(27-28-25(30)33)21-12-7-15-34-21)26-16-19-17-31(20-10-5-2-6-11-20)29-23(19)18-8-3-1-4-9-18/h1-12,15,17H,13-14,16H2,(H,26,32)(H,28,33)