6-bromanyl-3-(phenylsulfonyl)-1-(pyrrolidin-3-ylmethyl)pyrrolo[3,2-c]pyridine

Systemtic Name: 6-bromanyl-3-(phenylsulfonyl)-1-(pyrrolidin-3-ylmethyl)pyrrolo[3,2-c]pyridine Openeye Name: 3-(benzenesulfonyl)-6-bromo-1-(pyrrolidin-3-ylmethyl)pyrrolo[3,2-c]pyridine CAS Name: 3-(benzenesulfonyl)-6-bromo-1-(3-pyrrolidinylmethyl)pyrrolo[3,2-c]pyridine IUPAC Name: 3-(benzenesulfonyl)-6-bromo-1-(pyrrolidin-3-ylmethyl)pyrrolo[3,2-c]pyridine Traditional Name: 3-besyl-6-bromo-1-(pyrrolidin-3-ylmethyl)pyrrolo[3,2-c]pyridine Formula: C18H18BrN3O2S MolecularWeight: 420.32342

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCC1CN2C=C(C3=CN=C(C=C32)Br)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CNCC1CN2C=C(C3=CN=C(C=C32)Br)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C18H18BrN3O2S/c19-18-8-16-15(10-21-18)17(12-22(16)11-13-6-7-20-9-13)25(23,24)14-4-2-1-3-5-14/h1-5,8,10,12-13,20H,6-7,9,11H2