4-[(4-piperazin-1-yl-1H-pyrrolo[3,2-c]pyridin-2-yl)sulfonyl]benzenecarbonitrile hydrochloride

Systemtic Name: 4-[(4-piperazin-1-yl-1H-pyrrolo[3,2-c]pyridin-2-yl)sulfonyl]benzenecarbonitrile hydrochloride Openeye Name: 4-[(4-piperazin-1-yl-1H-pyrrolo[3,2-c]pyridin-2-yl)sulfonyl]benzonitrile hydrochloride CAS Name: 4-[[4-(1-piperazinyl)-1H-pyrrolo[3,2-c]pyridin-2-yl]sulfonyl]benzonitrile hydrochloride IUPAC Name: 4-[(4-piperazin-1-yl-1H-pyrrolo[3,2-c]pyridin-2-yl)sulfonyl]benzonitrile hydrochloride Traditional Name: 4-[(4-piperazino-1H-pyrrolo[3,2-c]pyridin-2-yl)sulfonyl]benzonitrile hydrochloride Formula: C18H18ClN5O2S MolecularWeight: 403.88582

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=NC=CC3=C2C=C(N3)S(=O)(=O)C4=CC=C(C=C4)C#N.Cl

Isomeric SMILES

C1CN(CCN1)C2=NC=CC3=C2C=C(N3)S(=O)(=O)C4=CC=C(C=C4)C#N.Cl

InChI

InChI=1S/C18H17N5O2S.ClH/c19-12-13-1-3-14(4-2-13)26(24,25)17-11-15-16(22-17)5-6-21-18(15)23-9-7-20-8-10-23;/h1-6,11,20,22H,7-10H2;1H