3-bromanyl-1-(phenylsulfonyl)-4-piperazin-1-yl-indole

Systemtic Name: 3-bromanyl-1-(phenylsulfonyl)-4-piperazin-1-yl-indole Openeye Name: 1-(benzenesulfonyl)-3-bromo-4-piperazin-1-yl-indole CAS Name: 1-(benzenesulfonyl)-3-bromo-4-(1-piperazinyl)indole IUPAC Name: 1-(benzenesulfonyl)-3-bromo-4-piperazin-1-ylindole Traditional Name: 1-besyl-3-bromo-4-piperazino-indole Formula: C18H18BrN3O2S MolecularWeight: 420.32342

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=CC=CC3=C2C(=CN3S(=O)(=O)C4=CC=CC=C4)Br

Isomeric SMILES

C1CN(CCN1)C2=CC=CC3=C2C(=CN3S(=O)(=O)C4=CC=CC=C4)Br

InChI

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