6-methoxy-2-[[1-(phenylmethyl)piperidin-4-yl]methyl]-1,2-dihydropyrrolo[1,2-a]indole-3-thione

Systemtic Name: 6-methoxy-2-[[1-(phenylmethyl)piperidin-4-yl]methyl]-1,2-dihydropyrrolo[1,2-a]indole-3-thione Openeye Name: 2-[(1-benzyl-4-piperidyl)methyl]-6-methoxy-1,2-dihydropyrrolo[1,2-a]indole-3-thione CAS Name: 6-methoxy-2-[[1-(phenylmethyl)-4-piperidinyl]methyl]-1,2-dihydropyrrolo[1,2-a]indole-3-thione IUPAC Name: 2-[(1-benzylpiperidin-4-yl)methyl]-6-methoxy-1,2-dihydropyrrolo[1,2-a]indole-3-thione Traditional Name: 2-[(1-benzyl-4-piperidyl)methyl]-6-methoxy-1,2-dihydropyrrol[1,2-a]indole-3-thione Formula: C25H28N2OS MolecularWeight: 404.56762

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N3CC(C(=S)C3=C2)CC4CCN(CC4)CC5=CC=CC=C5

Isomeric SMILES

COC1=CC2=C(C=C1)N3CC(C(=S)C3=C2)CC4CCN(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C25H28N2OS/c1-28-22-7-8-23-20(14-22)15-24-25(29)21(17-27(23)24)13-18-9-11-26(12-10-18)16-19-5-3-2-4-6-19/h2-8,14-15,18,21H,9-13,16-17H2,1H3