4-(7-methoxy-4,5-dihydro-1H-benzo[g]indazol-3-yl)-N-[2-(phenylmethylsulfanyl)ethyl]benzamide

Systemtic Name: 4-(7-methoxy-4,5-dihydro-1H-benzo[g]indazol-3-yl)-N-[2-(phenylmethylsulfanyl)ethyl]benzamide Openeye Name: N-(2-benzylsulfanylethyl)-4-(7-methoxy-4,5-dihydro-1H-benzo[g]indazol-3-yl)benzamide CAS Name: 4-(7-methoxy-4,5-dihydro-1H-benzo[g]indazol-3-yl)-N-[2-(phenylmethylthio)ethyl]benzamide IUPAC Name: N-(2-benzylsulfanylethyl)-4-(7-methoxy-4,5-dihydro-1H-benzo[g]indazol-3-yl)benzamide Traditional Name: N-[2-(benzylthio)ethyl]-4-(7-methoxy-4,5-dihydro-1H-benz[g]indazol-3-yl)benzamide Formula: C28H27N3O2S MolecularWeight: 469.59788

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C3=C(CC2)C(=NN3)C4=CC=C(C=C4)C(=O)NCCSCC5=CC=CC=C5

Isomeric SMILES

COC1=CC2=C(C=C1)C3=C(CC2)C(=NN3)C4=CC=C(C=C4)C(=O)NCCSCC5=CC=CC=C5

InChI

InChI=1S/C28H27N3O2S/c1-33-23-12-14-24-22(17-23)11-13-25-26(30-31-27(24)25)20-7-9-21(10-8-20)28(32)29-15-16-34-18-19-5-3-2-4-6-19/h2-10,12,14,17H,11,13,15-16,18H2,1H3,(H,29,32)(H,30,31)