5-azanyl-2-[4-(2-hydroxyethyl)piperazin-1-yl]sulfonyl-benzenecarbonitrile

Systemtic Name: 5-azanyl-2-[4-(2-hydroxyethyl)piperazin-1-yl]sulfonyl-benzenecarbonitrile Openeye Name: 5-amino-2-[4-(2-hydroxyethyl)piperazin-1-yl]sulfonyl-benzonitrile CAS Name: 5-amino-2-[[4-(2-hydroxyethyl)-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 5-amino-2-[4-(2-hydroxyethyl)piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 5-amino-2-[4-(2-hydroxyethyl)piperazino]sulfonyl-benzonitrile Formula: C13H18N4O3S MolecularWeight: 310.37202

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCO)S(=O)(=O)C2=C(C=C(C=C2)N)C#N

Isomeric SMILES

C1CN(CCN1CCO)S(=O)(=O)C2=C(C=C(C=C2)N)C#N

InChI

InChI=1S/C13H18N4O3S/c14-10-11-9-12(15)1-2-13(11)21(19,20)17-5-3-16(4-6-17)7-8-18/h1-2,9,18H,3-8,15H2