6-[(3R,5S)-3,5-dimethylpiperazin-1-yl]-5-methoxy-1-(4-pyridin-2-ylphenyl)sulfonyl-2,3-dihydroindole

Systemtic Name: 6-[(3R,5S)-3,5-dimethylpiperazin-1-yl]-5-methoxy-1-(4-pyridin-2-ylphenyl)sulfonyl-2,3-dihydroindole Openeye Name: 6-[(3R,5S)-3,5-dimethylpiperazin-1-yl]-5-methoxy-1-[4-(2-pyridyl)phenyl]sulfonyl-indoline CAS Name: 6-[(3R,5S)-3,5-dimethyl-1-piperazinyl]-5-methoxy-1-[4-(2-pyridinyl)phenyl]sulfonyl-2,3-dihydroindole IUPAC Name: 6-[(3R,5S)-3,5-dimethylpiperazin-1-yl]-5-methoxy-1-(4-pyridin-2-ylphenyl)sulfonyl-2,3-dihydroindole Traditional Name: 6-[(3R,5S)-3,5-dimethylpiperazino]-5-methoxy-1-[4-(2-pyridyl)phenyl]sulfonyl-indoline Formula: C26H30N4O3S MolecularWeight: 478.6064

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(N1)C)C2=C(C=C3CCN(C3=C2)S(=O)(=O)C4=CC=C(C=C4)C5=CC=CC=N5)OC

Isomeric SMILES

C[C@@H]1CN(C[C@@H](N1)C)C2=C(C=C3CCN(C3=C2)S(=O)(=O)C4=CC=C(C=C4)C5=CC=CC=N5)OC

InChI

InChI=1S/C26H30N4O3S/c1-18-16-29(17-19(2)28-18)25-15-24-21(14-26(25)33-3)11-13-30(24)34(31,32)22-9-7-20(8-10-22)23-6-4-5-12-27-23/h4-10,12,14-15,18-19,28H,11,13,16-17H2,1-3H3/t18-,19+