3-[2-[3-(4-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]ethanoylamino]-N,N-dimethyl-benzamide

Systemtic Name: 3-[2-[3-(4-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]ethanoylamino]-N,N-dimethyl-benzamide Openeye Name: 3-[[2-[3-(4-methoxyphenyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetyl]amino]-N,N-dimethyl-benzamide CAS Name: 3-[[2-[3-(4-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-1-oxoethyl]amino]-N,N-dimethylbenzamide IUPAC Name: 3-[[2-[3-(4-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]acetyl]amino]-N,N-dimethylbenzamide Traditional Name: 3-[[2-[3-(4-methoxyphenyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetyl]amino]-N,N-dimethyl-benzamide Formula: C20H21N5O3S MolecularWeight: 411.47744

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C1=CC(=CC=C1)NC(=O)CN2C(=NNC2=S)C3=CC=C(C=C3)OC

Isomeric SMILES

CN(C)C(=O)C1=CC(=CC=C1)NC(=O)CN2C(=NNC2=S)C3=CC=C(C=C3)OC

InChI

InChI=1S/C20H21N5O3S/c1-24(2)19(27)14-5-4-6-15(11-14)21-17(26)12-25-18(22-23-20(25)29)13-7-9-16(28-3)10-8-13/h4-11H,12H2,1-3H3,(H,21,26)(H,23,29)