N-(4-chloranyl-2-methoxy-5-methyl-phenyl)-2-[2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanoylamino]benzamide

Systemtic Name: N-(4-chloranyl-2-methoxy-5-methyl-phenyl)-2-[2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanoylamino]benzamide Openeye Name: N-(4-chloro-2-methoxy-5-methyl-phenyl)-2-[[2-(1H-1,2,4-triazol-5-ylsulfanyl)acetyl]amino]benzamide CAS Name: N-(4-chloro-2-methoxy-5-methylphenyl)-2-[[1-oxo-2-(1H-1,2,4-triazol-5-ylthio)ethyl]amino]benzamide IUPAC Name: N-(4-chloro-2-methoxy-5-methylphenyl)-2-[[2-(1H-1,2,4-triazol-5-ylsulfanyl)acetyl]amino]benzamide Traditional Name: N-(4-chloro-2-methoxy-5-methyl-phenyl)-2-[[2-(1H-1,2,4-triazol-5-ylthio)acetyl]amino]benzamide Formula: C19H18ClN5O3S MolecularWeight: 431.89592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)OC)NC(=O)C2=CC=CC=C2NC(=O)CSC3=NC=NN3

Isomeric SMILES

CC1=CC(=C(C=C1Cl)OC)NC(=O)C2=CC=CC=C2NC(=O)CSC3=NC=NN3

InChI

InChI=1S/C19H18ClN5O3S/c1-11-7-15(16(28-2)8-13(11)20)24-18(27)12-5-3-4-6-14(12)23-17(26)9-29-19-21-10-22-25-19/h3-8,10H,9H2,1-2H3,(H,23,26)(H,24,27)(H,21,22,25)