[1-(2-bromanyl-4-methoxy-phenyl)sulfonylindol-3-yl]-(4-methylpiperazin-1-yl)methanone

Systemtic Name: [1-(2-bromanyl-4-methoxy-phenyl)sulfonylindol-3-yl]-(4-methylpiperazin-1-yl)methanone Openeye Name: [1-(2-bromo-4-methoxy-phenyl)sulfonylindol-3-yl]-(4-methylpiperazin-1-yl)methanone CAS Name: [1-(2-bromo-4-methoxyphenyl)sulfonyl-3-indolyl]-(4-methyl-1-piperazinyl)methanone IUPAC Name: [1-(2-bromo-4-methoxyphenyl)sulfonylindol-3-yl]-(4-methylpiperazin-1-yl)methanone Traditional Name: [1-(2-bromo-4-methoxy-phenyl)sulfonylindol-3-yl]-(4-methylpiperazino)methanone Formula: C21H22BrN3O4S MolecularWeight: 492.38608

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)C2=CN(C3=CC=CC=C32)S(=O)(=O)C4=C(C=C(C=C4)OC)Br

Isomeric SMILES

CN1CCN(CC1)C(=O)C2=CN(C3=CC=CC=C32)S(=O)(=O)C4=C(C=C(C=C4)OC)Br

InChI

InChI=1S/C21H22BrN3O4S/c1-23-9-11-24(12-10-23)21(26)17-14-25(19-6-4-3-5-16(17)19)30(27,28)20-8-7-15(29-2)13-18(20)22/h3-8,13-14H,9-12H2,1-2H3