5-bromanyl-3-(3-oxidanylidenepiperazin-1-yl)sulfonyl-1H-indole-2-carboxamide

Systemtic Name: 5-bromanyl-3-(3-oxidanylidenepiperazin-1-yl)sulfonyl-1H-indole-2-carboxamide Openeye Name: 5-bromo-3-(3-oxopiperazin-1-yl)sulfonyl-1H-indole-2-carboxamide CAS Name: 5-bromo-3-[(3-oxo-1-piperazinyl)sulfonyl]-1H-indole-2-carboxamide IUPAC Name: 5-bromo-3-(3-oxopiperazin-1-yl)sulfonyl-1H-indole-2-carboxamide Traditional Name: 5-bromo-3-(3-ketopiperazino)sulfonyl-1H-indole-2-carboxamide Formula: C13H13BrN4O4S MolecularWeight: 401.23572

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)S(=O)(=O)C2=C(NC3=C2C=C(C=C3)Br)C(=O)N

Isomeric SMILES

C1CN(CC(=O)N1)S(=O)(=O)C2=C(NC3=C2C=C(C=C3)Br)C(=O)N

InChI

InChI=1S/C13H13BrN4O4S/c14-7-1-2-9-8(5-7)12(11(17-9)13(15)20)23(21,22)18-4-3-16-10(19)6-18/h1-2,5,17H,3-4,6H2,(H2,15,20)(H,16,19)