N-[(4S)-3,4-dihydro-2H-thiochromen-4-yl]-2-(4-piperidin-1-ylsulfonylphenyl)ethanamide

Systemtic Name: N-[(4S)-3,4-dihydro-2H-thiochromen-4-yl]-2-(4-piperidin-1-ylsulfonylphenyl)ethanamide Openeye Name: 2-[4-(1-piperidylsulfonyl)phenyl]-N-[(4S)-thiochroman-4-yl]acetamide CAS Name: N-[(4S)-3,4-dihydro-2H-1-benzothiopyran-4-yl]-2-[4-(1-piperidinylsulfonyl)phenyl]acetamide IUPAC Name: N-[(4S)-3,4-dihydro-2H-thiochromen-4-yl]-2-(4-piperidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-(4-piperidinosulfonylphenyl)-N-[(4S)-thiochroman-4-yl]acetamide Formula: C22H26N2O3S2 MolecularWeight: 430.58344

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CC(=O)NC3CCSC4=CC=CC=C34

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CC(=O)N[C@H]3CCSC4=CC=CC=C34

InChI

InChI=1S/C22H26N2O3S2/c25-22(23-20-12-15-28-21-7-3-2-6-19(20)21)16-17-8-10-18(11-9-17)29(26,27)24-13-4-1-5-14-24/h2-3,6-11,20H,1,4-5,12-16H2,(H,23,25)/t20-/m0/s1