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

Systemtic Name: N-[(1-phenylpyrazol-4-yl)methyl]-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide Openeye Name: N-[(1-phenylpyrazol-4-yl)methyl]-3-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propanamide CAS Name: N-[(1-phenyl-4-pyrazolyl)methyl]-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide IUPAC Name: N-[(1-phenylpyrazol-4-yl)methyl]-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide Traditional Name: N-[(1-phenylpyrazol-4-yl)methyl]-3-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propionamide Formula: C19H18N6OS2 MolecularWeight: 410.51582

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C=N2)CNC(=O)CCN3C(=NNC3=S)C4=CC=CS4

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C=N2)CNC(=O)CCN3C(=NNC3=S)C4=CC=CS4

InChI

InChI=1S/C19H18N6OS2/c26-17(8-9-24-18(22-23-19(24)27)16-7-4-10-28-16)20-11-14-12-21-25(13-14)15-5-2-1-3-6-15/h1-7,10,12-13H,8-9,11H2,(H,20,26)(H,23,27)