2-[2-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]-N-(1-phenylethyl)benzamide

Systemtic Name: 2-[2-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]-N-(1-phenylethyl)benzamide Openeye Name: 2-[[2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]-N-(1-phenylethyl)benzamide CAS Name: 2-[[2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-1-oxoethyl]amino]-N-(1-phenylethyl)benzamide IUPAC Name: 2-[[2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]-N-(1-phenylethyl)benzamide Traditional Name: 2-[[2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]acetyl]amino]-N-(1-phenylethyl)benzamide Formula: C19H20N6O2S MolecularWeight: 396.4661

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C2=CC=CC=C2NC(=O)CSC3=NNC(=N3)N

Isomeric SMILES

CC(C1=CC=CC=C1)NC(=O)C2=CC=CC=C2NC(=O)CSC3=NNC(=N3)N

InChI

InChI=1S/C19H20N6O2S/c1-12(13-7-3-2-4-8-13)21-17(27)14-9-5-6-10-15(14)22-16(26)11-28-19-23-18(20)24-25-19/h2-10,12H,11H2,1H3,(H,21,27)(H,22,26)(H3,20,23,24,25)