2-azanyl-5-bromanyl-N-[3-oxidanylidene-3-(4-pyridin-2-ylpiperazin-1-yl)propyl]pyridine-3-sulfonamide

Systemtic Name: 2-azanyl-5-bromanyl-N-[3-oxidanylidene-3-(4-pyridin-2-ylpiperazin-1-yl)propyl]pyridine-3-sulfonamide Openeye Name: 2-amino-5-bromo-N-[3-oxo-3-[4-(2-pyridyl)piperazin-1-yl]propyl]pyridine-3-sulfonamide CAS Name: 2-amino-5-bromo-N-[3-oxo-3-[4-(2-pyridinyl)-1-piperazinyl]propyl]-3-pyridinesulfonamide IUPAC Name: 2-amino-5-bromo-N-[3-oxo-3-(4-pyridin-2-ylpiperazin-1-yl)propyl]pyridine-3-sulfonamide Traditional Name: 2-amino-5-bromo-N-[3-keto-3-[4-(2-pyridyl)piperazino]propyl]pyridine-3-sulfonamide Formula: C17H21BrN6O3S MolecularWeight: 469.35604

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=N2)C(=O)CCNS(=O)(=O)C3=CC(=CN=C3N)Br

Isomeric SMILES

C1CN(CCN1C2=CC=CC=N2)C(=O)CCNS(=O)(=O)C3=CC(=CN=C3N)Br

InChI

InChI=1S/C17H21BrN6O3S/c18-13-11-14(17(19)21-12-13)28(26,27)22-6-4-16(25)24-9-7-23(8-10-24)15-3-1-2-5-20-15/h1-3,5,11-12,22H,4,6-10H2,(H2,19,21)