2-chloranyl-N-[3-(4-ethylpiperazin-1-yl)sulfonylphenyl]-5-methylsulfanyl-benzamide

Systemtic Name: 2-chloranyl-N-[3-(4-ethylpiperazin-1-yl)sulfonylphenyl]-5-methylsulfanyl-benzamide Openeye Name: 2-chloro-N-[3-(4-ethylpiperazin-1-yl)sulfonylphenyl]-5-methylsulfanyl-benzamide CAS Name: 2-chloro-N-[3-[(4-ethyl-1-piperazinyl)sulfonyl]phenyl]-5-(methylthio)benzamide IUPAC Name: 2-chloro-N-[3-(4-ethylpiperazin-1-yl)sulfonylphenyl]-5-methylsulfanylbenzamide Traditional Name: 2-chloro-N-[3-(4-ethylpiperazino)sulfonylphenyl]-5-(methylthio)benzamide Formula: C20H24ClN3O3S2 MolecularWeight: 454.00586

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)C3=C(C=CC(=C3)SC)Cl

Isomeric SMILES

CCN1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)C3=C(C=CC(=C3)SC)Cl

InChI

InChI=1S/C20H24ClN3O3S2/c1-3-23-9-11-24(12-10-23)29(26,27)17-6-4-5-15(13-17)22-20(25)18-14-16(28-2)7-8-19(18)21/h4-8,13-14H,3,9-12H2,1-2H3,(H,22,25)