4-methoxy-N-[[3-[2-oxidanylidene-2-[(4-propan-2-ylphenyl)amino]ethyl]sulfanyl-1H-1,2,4-triazol-5-yl]methyl]benzamide

Systemtic Name: 4-methoxy-N-[[3-[2-oxidanylidene-2-[(4-propan-2-ylphenyl)amino]ethyl]sulfanyl-1H-1,2,4-triazol-5-yl]methyl]benzamide Openeye Name: N-[[3-[2-(4-isopropylanilino)-2-oxo-ethyl]sulfanyl-1H-1,2,4-triazol-5-yl]methyl]-4-methoxy-benzamide CAS Name: 4-methoxy-N-[[3-[[2-oxo-2-(4-propan-2-ylanilino)ethyl]thio]-1H-1,2,4-triazol-5-yl]methyl]benzamide IUPAC Name: 4-methoxy-N-[[3-[2-oxo-2-(4-propan-2-ylanilino)ethyl]sulfanyl-1H-1,2,4-triazol-5-yl]methyl]benzamide Traditional Name: N-[[3-[(2-cumidino-2-keto-ethyl)thio]-1H-1,2,4-triazol-5-yl]methyl]-4-methoxy-benzamide Formula: C22H25N5O3S MolecularWeight: 439.5306

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC(=O)CSC2=NNC(=N2)CNC(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC(=O)CSC2=NNC(=N2)CNC(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H25N5O3S/c1-14(2)15-4-8-17(9-5-15)24-20(28)13-31-22-25-19(26-27-22)12-23-21(29)16-6-10-18(30-3)11-7-16/h4-11,14H,12-13H2,1-3H3,(H,23,29)(H,24,28)(H,25,26,27)