N-[4-[2-[4-(3,4-dihydro-2H-thiochromen-4-yl)piperazin-1-yl]ethyl]phenyl]methanesulfonamide

Systemtic Name: N-[4-[2-[4-(3,4-dihydro-2H-thiochromen-4-yl)piperazin-1-yl]ethyl]phenyl]methanesulfonamide Openeye Name: N-[4-[2-(4-thiochroman-4-ylpiperazin-1-yl)ethyl]phenyl]methanesulfonamide CAS Name: N-[4-[2-[4-(3,4-dihydro-2H-1-benzothiopyran-4-yl)-1-piperazinyl]ethyl]phenyl]methanesulfonamide IUPAC Name: N-[4-[2-[4-(3,4-dihydro-2H-thiochromen-4-yl)piperazin-1-yl]ethyl]phenyl]methanesulfonamide Traditional Name: N-[4-[2-(4-thiochroman-4-ylpiperazino)ethyl]phenyl]methanesulfonamide Formula: C22H29N3O2S2 MolecularWeight: 431.61456

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC=C(C=C1)CCN2CCN(CC2)C3CCSC4=CC=CC=C34

Isomeric SMILES

CS(=O)(=O)NC1=CC=C(C=C1)CCN2CCN(CC2)C3CCSC4=CC=CC=C34

InChI

InChI=1S/C22H29N3O2S2/c1-29(26,27)23-19-8-6-18(7-9-19)10-12-24-13-15-25(16-14-24)21-11-17-28-22-5-3-2-4-20(21)22/h2-9,21,23H,10-17H2,1H3