2-[(3,4-dichlorophenyl)sulfanylmethyl]-1-methyl-3-(piperidin-1-ylmethyl)indole hydrochloride

Systemtic Name: 2-[(3,4-dichlorophenyl)sulfanylmethyl]-1-methyl-3-(piperidin-1-ylmethyl)indole hydrochloride Openeye Name: 2-[(3,4-dichlorophenyl)sulfanylmethyl]-1-methyl-3-(1-piperidylmethyl)indole hydrochloride CAS Name: 2-[[(3,4-dichlorophenyl)thio]methyl]-1-methyl-3-(1-piperidinylmethyl)indole hydrochloride IUPAC Name: 2-[(3,4-dichlorophenyl)sulfanylmethyl]-1-methyl-3-(piperidin-1-ylmethyl)indole hydrochloride Traditional Name: 2-[[(3,4-dichlorophenyl)thio]methyl]-1-methyl-3-(piperidinomethyl)indole hydrochloride Formula: C22H25Cl3N2S MolecularWeight: 455.8713

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=C1CSC3=CC(=C(C=C3)Cl)Cl)CN4CCCCC4.Cl

Isomeric SMILES

CN1C2=CC=CC=C2C(=C1CSC3=CC(=C(C=C3)Cl)Cl)CN4CCCCC4.Cl

InChI

InChI=1S/C22H24Cl2N2S.ClH/c1-25-21-8-4-3-7-17(21)18(14-26-11-5-2-6-12-26)22(25)15-27-16-9-10-19(23)20(24)13-16;/h3-4,7-10,13H,2,5-6,11-12,14-15H2,1H3;1H