1-[5-bromanyl-7-[4-(2,3-dimethylphenyl)piperazin-1-yl]sulfonyl-2,3-dihydroindol-1-yl]ethanone

Systemtic Name: 1-[5-bromanyl-7-[4-(2,3-dimethylphenyl)piperazin-1-yl]sulfonyl-2,3-dihydroindol-1-yl]ethanone Openeye Name: 1-[5-bromo-7-[4-(2,3-dimethylphenyl)piperazin-1-yl]sulfonyl-indolin-1-yl]ethanone CAS Name: 1-[5-bromo-7-[[4-(2,3-dimethylphenyl)-1-piperazinyl]sulfonyl]-2,3-dihydroindol-1-yl]ethanone IUPAC Name: 1-[5-bromo-7-[4-(2,3-dimethylphenyl)piperazin-1-yl]sulfonyl-2,3-dihydroindol-1-yl]ethanone Traditional Name: 1-[5-bromo-7-[4-(2,3-dimethylphenyl)piperazino]sulfonyl-indolin-1-yl]ethanone Formula: C22H26BrN3O3S MolecularWeight: 492.42914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)S(=O)(=O)C3=C4C(=CC(=C3)Br)CCN4C(=O)C)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)S(=O)(=O)C3=C4C(=CC(=C3)Br)CCN4C(=O)C)C

InChI

InChI=1S/C22H26BrN3O3S/c1-15-5-4-6-20(16(15)2)24-9-11-25(12-10-24)30(28,29)21-14-19(23)13-18-7-8-26(17(3)27)22(18)21/h4-6,13-14H,7-12H2,1-3H3