1-[4-[(3S)-3-methoxypyrrolidin-1-yl]phenyl]sulfonyl-3-piperazin-1-yl-pyrrolo[3,2-b]pyridine

Systemtic Name: 1-[4-[(3S)-3-methoxypyrrolidin-1-yl]phenyl]sulfonyl-3-piperazin-1-yl-pyrrolo[3,2-b]pyridine Openeye Name: 1-[4-[(3S)-3-methoxypyrrolidin-1-yl]phenyl]sulfonyl-3-piperazin-1-yl-pyrrolo[3,2-b]pyridine CAS Name: 1-[4-[(3S)-3-methoxy-1-pyrrolidinyl]phenyl]sulfonyl-3-(1-piperazinyl)pyrrolo[3,2-b]pyridine IUPAC Name: 1-[4-[(3S)-3-methoxypyrrolidin-1-yl]phenyl]sulfonyl-3-piperazin-1-ylpyrrolo[3,2-b]pyridine Traditional Name: 1-[4-[(3S)-3-methoxypyrrolidino]phenyl]sulfonyl-3-piperazino-pyrrolo[3,2-b]pyridine Formula: C22H27N5O3S MolecularWeight: 441.54648

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Descriptors Computed from Structure

Canonical SMILES:

COC1CCN(C1)C2=CC=C(C=C2)S(=O)(=O)N3C=C(C4=C3C=CC=N4)N5CCNCC5

Isomeric SMILES

CO[C@H]1CCN(C1)C2=CC=C(C=C2)S(=O)(=O)N3C=C(C4=C3C=CC=N4)N5CCNCC5

InChI

InChI=1S/C22H27N5O3S/c1-30-18-8-12-26(15-18)17-4-6-19(7-5-17)31(28,29)27-16-21(25-13-10-23-11-14-25)22-20(27)3-2-9-24-22/h2-7,9,16,18,23H,8,10-15H2,1H3/t18-/m0/s1