4-[(5-piperazin-1-yl-1H-pyrrolo[2,3-b]pyridin-3-yl)sulfonyl]aniline

Systemtic Name: 4-[(5-piperazin-1-yl-1H-pyrrolo[2,3-b]pyridin-3-yl)sulfonyl]aniline Openeye Name: 4-[(5-piperazin-1-yl-1H-pyrrolo[2,3-b]pyridin-3-yl)sulfonyl]aniline CAS Name: 4-[[5-(1-piperazinyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]sulfonyl]aniline IUPAC Name: 4-[(5-piperazin-1-yl-1H-pyrrolo[2,3-b]pyridin-3-yl)sulfonyl]aniline Traditional Name: [4-[(5-piperazino-1H-pyrrolo[2,3-b]pyridin-3-yl)sulfonyl]phenyl]amine Formula: C17H19N5O2S MolecularWeight: 357.43006

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=CN=C3C(=C2)C(=CN3)S(=O)(=O)C4=CC=C(C=C4)N

Isomeric SMILES

C1CN(CCN1)C2=CN=C3C(=C2)C(=CN3)S(=O)(=O)C4=CC=C(C=C4)N

InChI

InChI=1S/C17H19N5O2S/c18-12-1-3-14(4-2-12)25(23,24)16-11-21-17-15(16)9-13(10-20-17)22-7-5-19-6-8-22/h1-4,9-11,19H,5-8,18H2,(H,20,21)