N-[(4S)-3,4-dihydro-2H-thiochromen-4-yl]-6-morpholin-4-ylsulfonyl-2-oxidanylidene-1H-quinoline-4-carboxamide

Systemtic Name: N-[(4S)-3,4-dihydro-2H-thiochromen-4-yl]-6-morpholin-4-ylsulfonyl-2-oxidanylidene-1H-quinoline-4-carboxamide Openeye Name: 6-morpholinosulfonyl-2-oxo-N-[(4S)-thiochroman-4-yl]-1H-quinoline-4-carboxamide CAS Name: N-[(4S)-3,4-dihydro-2H-1-benzothiopyran-4-yl]-6-(4-morpholinylsulfonyl)-2-oxo-1H-quinoline-4-carboxamide IUPAC Name: N-[(4S)-3,4-dihydro-2H-thiochromen-4-yl]-6-morpholin-4-ylsulfonyl-2-oxo-1H-quinoline-4-carboxamide Traditional Name: 2-keto-6-morpholinosulfonyl-N-[(4S)-thiochroman-4-yl]-1H-quinoline-4-carboxamide Formula: C23H23N3O5S2 MolecularWeight: 485.57582

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=CC=CC=C2C1NC(=O)C3=CC(=O)NC4=C3C=C(C=C4)S(=O)(=O)N5CCOCC5

Isomeric SMILES

C1CSC2=CC=CC=C2[C@H]1NC(=O)C3=CC(=O)NC4=C3C=C(C=C4)S(=O)(=O)N5CCOCC5

InChI

InChI=1S/C23H23N3O5S2/c27-22-14-18(23(28)25-20-7-12-32-21-4-2-1-3-16(20)21)17-13-15(5-6-19(17)24-22)33(29,30)26-8-10-31-11-9-26/h1-6,13-14,20H,7-12H2,(H,24,27)(H,25,28)/t20-/m0/s1