2-ethoxy-5-(4-methylpiperazin-1-yl)sulfonyl-benzenecarbonitrile

Systemtic Name: 2-ethoxy-5-(4-methylpiperazin-1-yl)sulfonyl-benzenecarbonitrile Openeye Name: 2-ethoxy-5-(4-methylpiperazin-1-yl)sulfonyl-benzonitrile CAS Name: 2-ethoxy-5-[(4-methyl-1-piperazinyl)sulfonyl]benzonitrile IUPAC Name: 2-ethoxy-5-(4-methylpiperazin-1-yl)sulfonylbenzonitrile Traditional Name: 2-ethoxy-5-(4-methylpiperazino)sulfonyl-benzonitrile Formula: C14H19N3O3S MolecularWeight: 309.38396

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C)C#N

Isomeric SMILES

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C)C#N

InChI

InChI=1S/C14H19N3O3S/c1-3-20-14-5-4-13(10-12(14)11-15)21(18,19)17-8-6-16(2)7-9-17/h4-5,10H,3,6-9H2,1-2H3