N-[(4S)-6-chloranyl-3,4-dihydro-2H-thiochromen-4-yl]-3-methylsulfonyl-benzamide

Systemtic Name: N-[(4S)-6-chloranyl-3,4-dihydro-2H-thiochromen-4-yl]-3-methylsulfonyl-benzamide Openeye Name: N-[(4S)-6-chlorothiochroman-4-yl]-3-methylsulfonyl-benzamide CAS Name: N-[(4S)-6-chloro-3,4-dihydro-2H-1-benzothiopyran-4-yl]-3-methylsulfonylbenzamide IUPAC Name: N-[(4S)-6-chloro-3,4-dihydro-2H-thiochromen-4-yl]-3-methylsulfonylbenzamide Traditional Name: N-[(4S)-6-chlorothiochroman-4-yl]-3-mesyl-benzamide Formula: C17H16ClNO3S2 MolecularWeight: 381.89684

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1)C(=O)NC2CCSC3=C2C=C(C=C3)Cl

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1)C(=O)N[C@H]2CCSC3=C2C=C(C=C3)Cl

InChI

InChI=1S/C17H16ClNO3S2/c1-24(21,22)13-4-2-3-11(9-13)17(20)19-15-7-8-23-16-6-5-12(18)10-14(15)16/h2-6,9-10,15H,7-8H2,1H3,(H,19,20)/t15-/m0/s1