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

Systemtic Name: 4-(methylsulfanylmethyl)-N-[1-(phenylmethyl)-4,5,6,7-tetrahydroindazol-4-yl]benzamide Openeye Name: N-(1-benzyl-4,5,6,7-tetrahydroindazol-4-yl)-4-(methylsulfanylmethyl)benzamide CAS Name: 4-[(methylthio)methyl]-N-[1-(phenylmethyl)-4,5,6,7-tetrahydroindazol-4-yl]benzamide IUPAC Name: N-(1-benzyl-4,5,6,7-tetrahydroindazol-4-yl)-4-(methylsulfanylmethyl)benzamide Traditional Name: N-(1-benzyl-4,5,6,7-tetrahydroindazol-4-yl)-4-[(methylthio)methyl]benzamide Formula: C23H25N3OS MolecularWeight: 391.5291

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCC1=CC=C(C=C1)C(=O)NC2CCCC3=C2C=NN3CC4=CC=CC=C4

Isomeric SMILES

CSCC1=CC=C(C=C1)C(=O)NC2CCCC3=C2C=NN3CC4=CC=CC=C4

InChI

InChI=1S/C23H25N3OS/c1-28-16-18-10-12-19(13-11-18)23(27)25-21-8-5-9-22-20(21)14-24-26(22)15-17-6-3-2-4-7-17/h2-4,6-7,10-14,21H,5,8-9,15-16H2,1H3,(H,25,27)