2-chloranyl-4-(4-methylpiperazin-1-yl)sulfonyl-benzenecarbonitrile

Systemtic Name: 2-chloranyl-4-(4-methylpiperazin-1-yl)sulfonyl-benzenecarbonitrile Openeye Name: 2-chloro-4-(4-methylpiperazin-1-yl)sulfonyl-benzonitrile CAS Name: 2-chloro-4-[(4-methyl-1-piperazinyl)sulfonyl]benzonitrile IUPAC Name: 2-chloro-4-(4-methylpiperazin-1-yl)sulfonylbenzonitrile Traditional Name: 2-chloro-4-(4-methylpiperazino)sulfonyl-benzonitrile Formula: C12H14ClN3O2S MolecularWeight: 299.77646

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)C#N)Cl

Isomeric SMILES

CN1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)C#N)Cl

InChI

InChI=1S/C12H14ClN3O2S/c1-15-4-6-16(7-5-15)19(17,18)11-3-2-10(9-14)12(13)8-11/h2-3,8H,4-7H2,1H3