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

Systemtic Name: 3-(methylsulfonylmethyl)-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]benzamide Openeye Name: 3-(methylsulfonylmethyl)-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]benzamide CAS Name: 3-(methylsulfonylmethyl)-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]benzamide IUPAC Name: 3-(methylsulfonylmethyl)-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]benzamide Traditional Name: 3-(mesylmethyl)-N-[4-(1,2,4-triazol-1-ylmethyl)benzyl]benzamide Formula: C19H20N4O3S MolecularWeight: 384.4521

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CC1=CC=CC(=C1)C(=O)NCC2=CC=C(C=C2)CN3C=NC=N3

Isomeric SMILES

CS(=O)(=O)CC1=CC=CC(=C1)C(=O)NCC2=CC=C(C=C2)CN3C=NC=N3

InChI

InChI=1S/C19H20N4O3S/c1-27(25,26)12-17-3-2-4-18(9-17)19(24)21-10-15-5-7-16(8-6-15)11-23-14-20-13-22-23/h2-9,13-14H,10-12H2,1H3,(H,21,24)