4-chloranyl-3-(phenylsulfonyl)-1-(piperidin-3-ylmethyl)pyrrolo[2,3-b]pyridine

Systemtic Name: 4-chloranyl-3-(phenylsulfonyl)-1-(piperidin-3-ylmethyl)pyrrolo[2,3-b]pyridine Openeye Name: 3-(benzenesulfonyl)-4-chloro-1-(3-piperidylmethyl)pyrrolo[2,3-b]pyridine CAS Name: 3-(benzenesulfonyl)-4-chloro-1-(3-piperidinylmethyl)pyrrolo[2,3-b]pyridine IUPAC Name: 3-(benzenesulfonyl)-4-chloro-1-(piperidin-3-ylmethyl)pyrrolo[2,3-b]pyridine Traditional Name: 3-besyl-4-chloro-1-(3-piperidylmethyl)pyrrolo[2,3-b]pyridine Formula: C19H20ClN3O2S MolecularWeight: 389.899

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CNC1)CN2C=C(C3=C(C=CN=C32)Cl)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CC(CNC1)CN2C=C(C3=C(C=CN=C32)Cl)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C19H20ClN3O2S/c20-16-8-10-22-19-18(16)17(26(24,25)15-6-2-1-3-7-15)13-23(19)12-14-5-4-9-21-11-14/h1-3,6-8,10,13-14,21H,4-5,9,11-12H2