3-(azepan-1-ylsulfonyl)-N-[3-(4-ethyl-1,2,4-triazol-3-yl)phenyl]benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N-[3-(4-ethyl-1,2,4-triazol-3-yl)phenyl]benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-N-[3-(4-ethyl-1,2,4-triazol-3-yl)phenyl]benzamide CAS Name: 3-(1-azepanylsulfonyl)-N-[3-(4-ethyl-1,2,4-triazol-3-yl)phenyl]benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N-[3-(4-ethyl-1,2,4-triazol-3-yl)phenyl]benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N-[3-(4-ethyl-1,2,4-triazol-3-yl)phenyl]benzamide Formula: C23H27N5O3S MolecularWeight: 453.55718

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=NN=C1C2=CC(=CC=C2)NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

CCN1C=NN=C1C2=CC(=CC=C2)NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C23H27N5O3S/c1-2-27-17-24-26-22(27)18-9-7-11-20(15-18)25-23(29)19-10-8-12-21(16-19)32(30,31)28-13-5-3-4-6-14-28/h7-12,15-17H,2-6,13-14H2,1H3,(H,25,29)