N-[2-(thiophen-2-ylmethyl)pyrazol-3-yl]-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide

Systemtic Name: N-[2-(thiophen-2-ylmethyl)pyrazol-3-yl]-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide Openeye Name: N-[2-(2-thienylmethyl)pyrazol-3-yl]-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide CAS Name: N-[2-(thiophen-2-ylmethyl)-3-pyrazolyl]-4-[(1H-1,2,4-triazol-5-ylthio)methyl]benzamide IUPAC Name: N-[2-(thiophen-2-ylmethyl)pyrazol-3-yl]-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide Traditional Name: N-[2-(2-thenyl)pyrazol-3-yl]-4-[(1H-1,2,4-triazol-5-ylthio)methyl]benzamide Formula: C18H16N6OS2 MolecularWeight: 396.48924

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CN2C(=CC=N2)NC(=O)C3=CC=C(C=C3)CSC4=NC=NN4

Isomeric SMILES

C1=CSC(=C1)CN2C(=CC=N2)NC(=O)C3=CC=C(C=C3)CSC4=NC=NN4

InChI

InChI=1S/C18H16N6OS2/c25-17(22-16-7-8-21-24(16)10-15-2-1-9-26-15)14-5-3-13(4-6-14)11-27-18-19-12-20-23-18/h1-9,12H,10-11H2,(H,22,25)(H,19,20,23)