N-(4-methoxyphenyl)-2-[2-[(5-oxidanylidene-4-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]benzamide

Systemtic Name: N-(4-methoxyphenyl)-2-[2-[(5-oxidanylidene-4-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]benzamide Openeye Name: N-(4-methoxyphenyl)-2-[[2-[(5-oxo-4-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzamide CAS Name: N-(4-methoxyphenyl)-2-[[1-oxo-2-[(5-oxo-4-propyl-1H-1,2,4-triazol-3-yl)thio]ethyl]amino]benzamide IUPAC Name: N-(4-methoxyphenyl)-2-[[2-[(5-oxo-4-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzamide Traditional Name: 2-[[2-[(5-keto-4-propyl-1H-1,2,4-triazol-3-yl)thio]acetyl]amino]-N-(4-methoxyphenyl)benzamide Formula: C21H23N5O4S MolecularWeight: 441.50342

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)NN=C1SCC(=O)NC2=CC=CC=C2C(=O)NC3=CC=C(C=C3)OC

Isomeric SMILES

CCCN1C(=O)NN=C1SCC(=O)NC2=CC=CC=C2C(=O)NC3=CC=C(C=C3)OC

InChI

InChI=1S/C21H23N5O4S/c1-3-12-26-20(29)24-25-21(26)31-13-18(27)23-17-7-5-4-6-16(17)19(28)22-14-8-10-15(30-2)11-9-14/h4-11H,3,12-13H2,1-2H3,(H,22,28)(H,23,27)(H,24,29)