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

Systemtic Name: 2-[2-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]-N-cyclopentyl-benzamide Openeye Name: 2-[[2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]-N-cyclopentyl-benzamide CAS Name: 2-[[2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-1-oxoethyl]amino]-N-cyclopentylbenzamide IUPAC Name: 2-[[2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]-N-cyclopentylbenzamide Traditional Name: 2-[[2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]acetyl]amino]-N-cyclopentyl-benzamide Formula: C16H20N6O2S MolecularWeight: 360.434

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=O)C2=CC=CC=C2NC(=O)CSC3=NNC(=N3)N

Isomeric SMILES

C1CCC(C1)NC(=O)C2=CC=CC=C2NC(=O)CSC3=NNC(=N3)N

InChI

InChI=1S/C16H20N6O2S/c17-15-20-16(22-21-15)25-9-13(23)19-12-8-4-3-7-11(12)14(24)18-10-5-1-2-6-10/h3-4,7-8,10H,1-2,5-6,9H2,(H,18,24)(H,19,23)(H3,17,20,21,22)