2-methylsulfonyl-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]benzamide

Systemtic Name: 2-methylsulfonyl-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]benzamide Openeye Name: 2-methylsulfonyl-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]benzamide CAS Name: 2-methylsulfonyl-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]benzamide IUPAC Name: 2-methylsulfonyl-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]benzamide Traditional Name: 2-mesyl-N-[4-(1,2,4-triazol-1-ylmethyl)benzyl]benzamide Formula: C18H18N4O3S MolecularWeight: 370.42552

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1C(=O)NCC2=CC=C(C=C2)CN3C=NC=N3

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1C(=O)NCC2=CC=C(C=C2)CN3C=NC=N3

InChI

InChI=1S/C18H18N4O3S/c1-26(24,25)17-5-3-2-4-16(17)18(23)20-10-14-6-8-15(9-7-14)11-22-13-19-12-21-22/h2-9,12-13H,10-11H2,1H3,(H,20,23)