1-[4-[5-(aminomethyl)-2-methyl-phenyl]sulfonylpiperazin-1-yl]ethanone

Systemtic Name: 1-[4-[5-(aminomethyl)-2-methyl-phenyl]sulfonylpiperazin-1-yl]ethanone Openeye Name: 1-[4-[5-(aminomethyl)-2-methyl-phenyl]sulfonylpiperazin-1-yl]ethanone CAS Name: 1-[4-[5-(aminomethyl)-2-methylphenyl]sulfonyl-1-piperazinyl]ethanone IUPAC Name: 1-[4-[5-(aminomethyl)-2-methylphenyl]sulfonylpiperazin-1-yl]ethanone Traditional Name: 1-[4-[5-(aminomethyl)-2-methyl-phenyl]sulfonylpiperazino]ethanone Formula: C14H21N3O3S MolecularWeight: 311.39984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CN)S(=O)(=O)N2CCN(CC2)C(=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)CN)S(=O)(=O)N2CCN(CC2)C(=O)C

InChI

InChI=1S/C14H21N3O3S/c1-11-3-4-13(10-15)9-14(11)21(19,20)17-7-5-16(6-8-17)12(2)18/h3-4,9H,5-8,10,15H2,1-2H3