5-chloranyl-1,2-dimethyl-3-[1-(phenylmethyl)piperidin-4-yl]sulfanyl-indole

Systemtic Name: 5-chloranyl-1,2-dimethyl-3-[1-(phenylmethyl)piperidin-4-yl]sulfanyl-indole Openeye Name: 3-[(1-benzyl-4-piperidyl)sulfanyl]-5-chloro-1,2-dimethyl-indole CAS Name: 5-chloro-1,2-dimethyl-3-[[1-(phenylmethyl)-4-piperidinyl]thio]indole IUPAC Name: 3-(1-benzylpiperidin-4-yl)sulfanyl-5-chloro-1,2-dimethylindole Traditional Name: 3-[(1-benzyl-4-piperidyl)thio]-5-chloro-1,2-dimethyl-indole Formula: C22H25ClN2S MolecularWeight: 384.9653

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1C)C=CC(=C2)Cl)SC3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CC1=C(C2=C(N1C)C=CC(=C2)Cl)SC3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C22H25ClN2S/c1-16-22(20-14-18(23)8-9-21(20)24(16)2)26-19-10-12-25(13-11-19)15-17-6-4-3-5-7-17/h3-9,14,19H,10-13,15H2,1-2H3