N-[(4S)-3,4-dihydro-2H-thiochromen-4-yl]-4-methyl-3-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: N-[(4S)-3,4-dihydro-2H-thiochromen-4-yl]-4-methyl-3-morpholin-4-ylsulfonyl-benzamide Openeye Name: 4-methyl-3-morpholinosulfonyl-N-[(4S)-thiochroman-4-yl]benzamide CAS Name: N-[(4S)-3,4-dihydro-2H-1-benzothiopyran-4-yl]-4-methyl-3-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-[(4S)-3,4-dihydro-2H-thiochromen-4-yl]-4-methyl-3-morpholin-4-ylsulfonylbenzamide Traditional Name: 4-methyl-3-morpholinosulfonyl-N-[(4S)-thiochroman-4-yl]benzamide Formula: C21H24N2O4S2 MolecularWeight: 432.55626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2CCSC3=CC=CC=C23)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N[C@H]2CCSC3=CC=CC=C23)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C21H24N2O4S2/c1-15-6-7-16(14-20(15)29(25,26)23-9-11-27-12-10-23)21(24)22-18-8-13-28-19-5-3-2-4-17(18)19/h2-7,14,18H,8-13H2,1H3,(H,22,24)/t18-/m0/s1