4-(3-methylbutoxy)-N-[3-(3-methylsulfanyl-1,2,4-triazol-4-yl)phenyl]benzamide

Systemtic Name: 4-(3-methylbutoxy)-N-[3-(3-methylsulfanyl-1,2,4-triazol-4-yl)phenyl]benzamide Openeye Name: 4-isopentyloxy-N-[3-(3-methylsulfanyl-1,2,4-triazol-4-yl)phenyl]benzamide CAS Name: 4-(3-methylbutoxy)-N-[3-[3-(methylthio)-1,2,4-triazol-4-yl]phenyl]benzamide IUPAC Name: 4-(3-methylbutoxy)-N-[3-(3-methylsulfanyl-1,2,4-triazol-4-yl)phenyl]benzamide Traditional Name: 4-isoamoxy-N-[3-[3-(methylthio)-1,2,4-triazol-4-yl]phenyl]benzamide Formula: C21H24N4O2S MolecularWeight: 396.50586

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=C(C=C1)C(=O)NC2=CC=CC(=C2)N3C=NN=C3SC

Isomeric SMILES

CC(C)CCOC1=CC=C(C=C1)C(=O)NC2=CC=CC(=C2)N3C=NN=C3SC

InChI

InChI=1S/C21H24N4O2S/c1-15(2)11-12-27-19-9-7-16(8-10-19)20(26)23-17-5-4-6-18(13-17)25-14-22-24-21(25)28-3/h4-10,13-15H,11-12H2,1-3H3,(H,23,26)