N-[2-(4-methylsulfonylpiperazin-1-yl)ethyl]-3-phenylsulfanyl-propanamide

Systemtic Name: N-[2-(4-methylsulfonylpiperazin-1-yl)ethyl]-3-phenylsulfanyl-propanamide Openeye Name: N-[2-(4-methylsulfonylpiperazin-1-yl)ethyl]-3-phenylsulfanyl-propanamide CAS Name: N-[2-(4-methylsulfonyl-1-piperazinyl)ethyl]-3-(phenylthio)propanamide IUPAC Name: N-[2-(4-methylsulfonylpiperazin-1-yl)ethyl]-3-phenylsulfanylpropanamide Traditional Name: N-[2-(4-mesylpiperazino)ethyl]-3-(phenylthio)propionamide Formula: C16H25N3O3S2 MolecularWeight: 371.518

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCN(CC1)CCNC(=O)CCSC2=CC=CC=C2

Isomeric SMILES

CS(=O)(=O)N1CCN(CC1)CCNC(=O)CCSC2=CC=CC=C2

InChI

InChI=1S/C16H25N3O3S2/c1-24(21,22)19-12-10-18(11-13-19)9-8-17-16(20)7-14-23-15-5-3-2-4-6-15/h2-6H,7-14H2,1H3,(H,17,20)