N-naphthalen-1-yl-4-[2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanoylamino]benzamide

Systemtic Name: N-naphthalen-1-yl-4-[2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanoylamino]benzamide Openeye Name: N-(1-naphthyl)-4-[[2-(1H-1,2,4-triazol-5-ylsulfanyl)acetyl]amino]benzamide CAS Name: N-(1-naphthalenyl)-4-[[1-oxo-2-(1H-1,2,4-triazol-5-ylthio)ethyl]amino]benzamide IUPAC Name: N-naphthalen-1-yl-4-[[2-(1H-1,2,4-triazol-5-ylsulfanyl)acetyl]amino]benzamide Traditional Name: N-(1-naphthyl)-4-[[2-(1H-1,2,4-triazol-5-ylthio)acetyl]amino]benzamide Formula: C21H17N5O2S MolecularWeight: 403.45698

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2NC(=O)C3=CC=C(C=C3)NC(=O)CSC4=NC=NN4

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2NC(=O)C3=CC=C(C=C3)NC(=O)CSC4=NC=NN4

InChI

InChI=1S/C21H17N5O2S/c27-19(12-29-21-22-13-23-26-21)24-16-10-8-15(9-11-16)20(28)25-18-7-3-5-14-4-1-2-6-17(14)18/h1-11,13H,12H2,(H,24,27)(H,25,28)(H,22,23,26)