N-[(4S)-3,4-dihydro-2H-thiochromen-4-yl]-2-[2-(2-methoxyethylamino)-2-oxidanylidene-ethyl]sulfanyl-benzamide

Systemtic Name: N-[(4S)-3,4-dihydro-2H-thiochromen-4-yl]-2-[2-(2-methoxyethylamino)-2-oxidanylidene-ethyl]sulfanyl-benzamide Openeye Name: 2-[2-(2-methoxyethylamino)-2-oxo-ethyl]sulfanyl-N-[(4S)-thiochroman-4-yl]benzamide CAS Name: N-[(4S)-3,4-dihydro-2H-1-benzothiopyran-4-yl]-2-[[2-(2-methoxyethylamino)-2-oxoethyl]thio]benzamide IUPAC Name: N-[(4S)-3,4-dihydro-2H-thiochromen-4-yl]-2-[2-(2-methoxyethylamino)-2-oxoethyl]sulfanylbenzamide Traditional Name: 2-[[2-keto-2-(2-methoxyethylamino)ethyl]thio]-N-[(4S)-thiochroman-4-yl]benzamide Formula: C21H24N2O3S2 MolecularWeight: 416.55686

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC(=O)CSC1=CC=CC=C1C(=O)NC2CCSC3=CC=CC=C23

Isomeric SMILES

COCCNC(=O)CSC1=CC=CC=C1C(=O)N[C@H]2CCSC3=CC=CC=C23

InChI

InChI=1S/C21H24N2O3S2/c1-26-12-11-22-20(24)14-28-19-9-5-3-7-16(19)21(25)23-17-10-13-27-18-8-4-2-6-15(17)18/h2-9,17H,10-14H2,1H3,(H,22,24)(H,23,25)/t17-/m0/s1