2-[(2,5-dimethylphenyl)sulfonylamino]-N-[6-(4-methylpiperazin-1-yl)pyridin-3-yl]-4-methylsulfanyl-butanamide

Systemtic Name: 2-[(2,5-dimethylphenyl)sulfonylamino]-N-[6-(4-methylpiperazin-1-yl)pyridin-3-yl]-4-methylsulfanyl-butanamide Openeye Name: 2-[(2,5-dimethylphenyl)sulfonylamino]-N-[6-(4-methylpiperazin-1-yl)-3-pyridyl]-4-methylsulfanyl-butanamide CAS Name: 2-[(2,5-dimethylphenyl)sulfonylamino]-N-[6-(4-methyl-1-piperazinyl)-3-pyridinyl]-4-(methylthio)butanamide IUPAC Name: 2-[(2,5-dimethylphenyl)sulfonylamino]-N-[6-(4-methylpiperazin-1-yl)pyridin-3-yl]-4-methylsulfanylbutanamide Traditional Name: 2-[(2,5-dimethylphenyl)sulfonylamino]-N-[6-(4-methylpiperazino)-3-pyridyl]-4-(methylthio)butyramide Formula: C23H33N5O3S2 MolecularWeight: 491.66982

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)NC(CCSC)C(=O)NC2=CN=C(C=C2)N3CCN(CC3)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)NC(CCSC)C(=O)NC2=CN=C(C=C2)N3CCN(CC3)C

InChI

InChI=1S/C23H33N5O3S2/c1-17-5-6-18(2)21(15-17)33(30,31)26-20(9-14-32-4)23(29)25-19-7-8-22(24-16-19)28-12-10-27(3)11-13-28/h5-8,15-16,20,26H,9-14H2,1-4H3,(H,25,29)