3-ethyl-1-[3-[(3S)-3-methoxypyrrolidin-1-yl]phenyl]sulfonyl-6-piperazin-1-yl-indole

Systemtic Name: 3-ethyl-1-[3-[(3S)-3-methoxypyrrolidin-1-yl]phenyl]sulfonyl-6-piperazin-1-yl-indole Openeye Name: 3-ethyl-1-[3-[(3S)-3-methoxypyrrolidin-1-yl]phenyl]sulfonyl-6-piperazin-1-yl-indole CAS Name: 3-ethyl-1-[3-[(3S)-3-methoxy-1-pyrrolidinyl]phenyl]sulfonyl-6-(1-piperazinyl)indole IUPAC Name: 3-ethyl-1-[3-[(3S)-3-methoxypyrrolidin-1-yl]phenyl]sulfonyl-6-piperazin-1-ylindole Traditional Name: 3-ethyl-1-[3-[(3S)-3-methoxypyrrolidino]phenyl]sulfonyl-6-piperazino-indole Formula: C25H32N4O3S MolecularWeight: 468.61158

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CN(C2=C1C=CC(=C2)N3CCNCC3)S(=O)(=O)C4=CC=CC(=C4)N5CCC(C5)OC

Isomeric SMILES

CCC1=CN(C2=C1C=CC(=C2)N3CCNCC3)S(=O)(=O)C4=CC=CC(=C4)N5CC[C@@H](C5)OC

InChI

InChI=1S/C25H32N4O3S/c1-3-19-17-29(25-16-21(7-8-24(19)25)27-13-10-26-11-14-27)33(30,31)23-6-4-5-20(15-23)28-12-9-22(18-28)32-2/h4-8,15-17,22,26H,3,9-14,18H2,1-2H3/t22-/m0/s1