3-(methylsulfinylmethyl)-N-[1-(phenylmethyl)-4,5,6,7-tetrahydroindazol-4-yl]benzamide

Systemtic Name: 3-(methylsulfinylmethyl)-N-[1-(phenylmethyl)-4,5,6,7-tetrahydroindazol-4-yl]benzamide Openeye Name: N-(1-benzyl-4,5,6,7-tetrahydroindazol-4-yl)-3-(methylsulfinylmethyl)benzamide CAS Name: 3-(methylsulfinylmethyl)-N-[1-(phenylmethyl)-4,5,6,7-tetrahydroindazol-4-yl]benzamide IUPAC Name: N-(1-benzyl-4,5,6,7-tetrahydroindazol-4-yl)-3-(methylsulfinylmethyl)benzamide Traditional Name: N-(1-benzyl-4,5,6,7-tetrahydroindazol-4-yl)-3-(methylsulfinylmethyl)benzamide Formula: C23H25N3O2S MolecularWeight: 407.5285

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)CC1=CC=CC(=C1)C(=O)NC2CCCC3=C2C=NN3CC4=CC=CC=C4

Isomeric SMILES

CS(=O)CC1=CC=CC(=C1)C(=O)NC2CCCC3=C2C=NN3CC4=CC=CC=C4

InChI

InChI=1S/C23H25N3O2S/c1-29(28)16-18-9-5-10-19(13-18)23(27)25-21-11-6-12-22-20(21)14-24-26(22)15-17-7-3-2-4-8-17/h2-5,7-10,13-14,21H,6,11-12,15-16H2,1H3,(H,25,27)