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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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