N-(3-ethylphenyl)-5-nitro-2-(1H-1,2,4-triazol-5-ylsulfanyl)benzamide

Systemtic Name: N-(3-ethylphenyl)-5-nitro-2-(1H-1,2,4-triazol-5-ylsulfanyl)benzamide Openeye Name: N-(3-ethylphenyl)-5-nitro-2-(1H-1,2,4-triazol-5-ylsulfanyl)benzamide CAS Name: N-(3-ethylphenyl)-5-nitro-2-(1H-1,2,4-triazol-5-ylthio)benzamide IUPAC Name: N-(3-ethylphenyl)-5-nitro-2-(1H-1,2,4-triazol-5-ylsulfanyl)benzamide Traditional Name: N-(3-ethylphenyl)-5-nitro-2-(1H-1,2,4-triazol-5-ylthio)benzamide Formula: C17H15N5O3S MolecularWeight: 369.3977

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])SC3=NC=NN3

Isomeric SMILES

CCC1=CC(=CC=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])SC3=NC=NN3

InChI

InChI=1S/C17H15N5O3S/c1-2-11-4-3-5-12(8-11)20-16(23)14-9-13(22(24)25)6-7-15(14)26-17-18-10-19-21-17/h3-10H,2H2,1H3,(H,20,23)(H,18,19,21)