N-[1-(phenylmethyl)-4,5,6,7-tetrahydroindazol-4-yl]-2-phenylsulfanyl-propanamide

Systemtic Name: N-[1-(phenylmethyl)-4,5,6,7-tetrahydroindazol-4-yl]-2-phenylsulfanyl-propanamide Openeye Name: N-(1-benzyl-4,5,6,7-tetrahydroindazol-4-yl)-2-phenylsulfanyl-propanamide CAS Name: N-[1-(phenylmethyl)-4,5,6,7-tetrahydroindazol-4-yl]-2-(phenylthio)propanamide IUPAC Name: N-(1-benzyl-4,5,6,7-tetrahydroindazol-4-yl)-2-phenylsulfanylpropanamide Traditional Name: N-(1-benzyl-4,5,6,7-tetrahydroindazol-4-yl)-2-(phenylthio)propionamide Formula: C23H25N3OS MolecularWeight: 391.5291

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCCC2=C1C=NN2CC3=CC=CC=C3)SC4=CC=CC=C4

Isomeric SMILES

CC(C(=O)NC1CCCC2=C1C=NN2CC3=CC=CC=C3)SC4=CC=CC=C4

InChI

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