1-(3-bromophenyl)sulfonyl-5-methoxy-6-[(3S,5R)-3,4,5-trimethylpiperazin-1-yl]-2,3-dihydroindole

Systemtic Name: 1-(3-bromophenyl)sulfonyl-5-methoxy-6-[(3S,5R)-3,4,5-trimethylpiperazin-1-yl]-2,3-dihydroindole Openeye Name: 1-(3-bromophenyl)sulfonyl-5-methoxy-6-[(3S,5R)-3,4,5-trimethylpiperazin-1-yl]indoline CAS Name: 1-(3-bromophenyl)sulfonyl-5-methoxy-6-[(3S,5R)-3,4,5-trimethyl-1-piperazinyl]-2,3-dihydroindole IUPAC Name: 1-(3-bromophenyl)sulfonyl-5-methoxy-6-[(3S,5R)-3,4,5-trimethylpiperazin-1-yl]-2,3-dihydroindole Traditional Name: 1-(3-bromophenyl)sulfonyl-5-methoxy-6-[(3S,5R)-3,4,5-trimethylpiperazino]indoline Formula: C22H28BrN3O3S MolecularWeight: 494.44502

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(N1C)C)C2=C(C=C3CCN(C3=C2)S(=O)(=O)C4=CC(=CC=C4)Br)OC

Isomeric SMILES

C[C@@H]1CN(C[C@@H](N1C)C)C2=C(C=C3CCN(C3=C2)S(=O)(=O)C4=CC(=CC=C4)Br)OC

InChI

InChI=1S/C22H28BrN3O3S/c1-15-13-25(14-16(2)24(15)3)21-12-20-17(10-22(21)29-4)8-9-26(20)30(27,28)19-7-5-6-18(23)11-19/h5-7,10-12,15-16H,8-9,13-14H2,1-4H3/t15-,16+