5-bromanyl-3-[4-[3-(dimethylamino)propyl]-3-oxidanylidene-piperazin-1-yl]sulfonyl-1H-indole-2-carboxamide

Systemtic Name: 5-bromanyl-3-[4-[3-(dimethylamino)propyl]-3-oxidanylidene-piperazin-1-yl]sulfonyl-1H-indole-2-carboxamide Openeye Name: 5-bromo-3-[4-[3-(dimethylamino)propyl]-3-oxo-piperazin-1-yl]sulfonyl-1H-indole-2-carboxamide CAS Name: 5-bromo-3-[[4-[3-(dimethylamino)propyl]-3-oxo-1-piperazinyl]sulfonyl]-1H-indole-2-carboxamide IUPAC Name: 5-bromo-3-[4-[3-(dimethylamino)propyl]-3-oxopiperazin-1-yl]sulfonyl-1H-indole-2-carboxamide Traditional Name: 5-bromo-3-[4-[3-(dimethylamino)propyl]-3-keto-piperazino]sulfonyl-1H-indole-2-carboxamide Formula: C18H24BrN5O4S MolecularWeight: 486.38326

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCN1CCN(CC1=O)S(=O)(=O)C2=C(NC3=C2C=C(C=C3)Br)C(=O)N

Isomeric SMILES

CN(C)CCCN1CCN(CC1=O)S(=O)(=O)C2=C(NC3=C2C=C(C=C3)Br)C(=O)N

InChI

InChI=1S/C18H24BrN5O4S/c1-22(2)6-3-7-23-8-9-24(11-15(23)25)29(27,28)17-13-10-12(19)4-5-14(13)21-16(17)18(20)26/h4-5,10,21H,3,6-9,11H2,1-2H3,(H2,20,26)