3-(4-piperazin-1-ylindol-1-yl)sulfonylbenzenecarbonitrile hydrochloride

Systemtic Name: 3-(4-piperazin-1-ylindol-1-yl)sulfonylbenzenecarbonitrile hydrochloride Openeye Name: 3-(4-piperazin-1-ylindol-1-yl)sulfonylbenzonitrile hydrochloride CAS Name: 3-[[4-(1-piperazinyl)-1-indolyl]sulfonyl]benzonitrile hydrochloride IUPAC Name: 3-(4-piperazin-1-ylindol-1-yl)sulfonylbenzonitrile hydrochloride Traditional Name: 3-(4-piperazinoindol-1-yl)sulfonylbenzonitrile hydrochloride Formula: C19H19ClN4O2S MolecularWeight: 402.89776

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=CC=CC3=C2C=CN3S(=O)(=O)C4=CC=CC(=C4)C#N.Cl

Isomeric SMILES

C1CN(CCN1)C2=CC=CC3=C2C=CN3S(=O)(=O)C4=CC=CC(=C4)C#N.Cl

InChI

InChI=1S/C19H18N4O2S.ClH/c20-14-15-3-1-4-16(13-15)26(24,25)23-10-7-17-18(5-2-6-19(17)23)22-11-8-21-9-12-22;/h1-7,10,13,21H,8-9,11-12H2;1H