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

Systemtic Name: 4-[2-[[5-(2-cyclopentylethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethanoylamino]benzamide Openeye Name: 4-[[2-[[5-(2-cyclopentylethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzamide CAS Name: 4-[[2-[[5-(2-cyclopentylethyl)-1H-1,2,4-triazol-3-yl]thio]-1-oxoethyl]amino]benzamide IUPAC Name: 4-[[2-[[5-(2-cyclopentylethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzamide Traditional Name: 4-[[2-[[5-(2-cyclopentylethyl)-1H-1,2,4-triazol-3-yl]thio]acetyl]amino]benzamide Formula: C18H23N5O2S MolecularWeight: 373.47252

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)CCC2=NC(=NN2)SCC(=O)NC3=CC=C(C=C3)C(=O)N

Isomeric SMILES

C1CCC(C1)CCC2=NC(=NN2)SCC(=O)NC3=CC=C(C=C3)C(=O)N

InChI

InChI=1S/C18H23N5O2S/c19-17(25)13-6-8-14(9-7-13)20-16(24)11-26-18-21-15(22-23-18)10-5-12-3-1-2-4-12/h6-9,12H,1-5,10-11H2,(H2,19,25)(H,20,24)(H,21,22,23)