3-[4-(5-chloranylthiophen-2-yl)sulfonylpiperazin-1-yl]-N-(2-methylsulfanylphenyl)propanamide

Systemtic Name: 3-[4-(5-chloranylthiophen-2-yl)sulfonylpiperazin-1-yl]-N-(2-methylsulfanylphenyl)propanamide Openeye Name: 3-[4-[(5-chloro-2-thienyl)sulfonyl]piperazin-1-yl]-N-(2-methylsulfanylphenyl)propanamide CAS Name: 3-[4-[(5-chloro-2-thiophenyl)sulfonyl]-1-piperazinyl]-N-[2-(methylthio)phenyl]propanamide IUPAC Name: 3-[4-(5-chlorothiophen-2-yl)sulfonylpiperazin-1-yl]-N-(2-methylsulfanylphenyl)propanamide Traditional Name: 3-[4-[(5-chloro-2-thienyl)sulfonyl]piperazino]-N-[2-(methylthio)phenyl]propionamide Formula: C18H22ClN3O3S3 MolecularWeight: 460.03358

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1NC(=O)CCN2CCN(CC2)S(=O)(=O)C3=CC=C(S3)Cl

Isomeric SMILES

CSC1=CC=CC=C1NC(=O)CCN2CCN(CC2)S(=O)(=O)C3=CC=C(S3)Cl

InChI

InChI=1S/C18H22ClN3O3S3/c1-26-15-5-3-2-4-14(15)20-17(23)8-9-21-10-12-22(13-11-21)28(24,25)18-7-6-16(19)27-18/h2-7H,8-13H2,1H3,(H,20,23)