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

Systemtic Name: N-[(4S)-6-chloranyl-3,4-dihydro-2H-thiochromen-4-yl]-3,4-dimethoxy-benzamide Openeye Name: N-[(4S)-6-chlorothiochroman-4-yl]-3,4-dimethoxy-benzamide CAS Name: N-[(4S)-6-chloro-3,4-dihydro-2H-1-benzothiopyran-4-yl]-3,4-dimethoxybenzamide IUPAC Name: N-[(4S)-6-chloro-3,4-dihydro-2H-thiochromen-4-yl]-3,4-dimethoxybenzamide Traditional Name: N-[(4S)-6-chlorothiochroman-4-yl]-3,4-dimethoxy-benzamide Formula: C18H18ClNO3S MolecularWeight: 363.85842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2CCSC3=C2C=C(C=C3)Cl)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N[C@H]2CCSC3=C2C=C(C=C3)Cl)OC

InChI

InChI=1S/C18H18ClNO3S/c1-22-15-5-3-11(9-16(15)23-2)18(21)20-14-7-8-24-17-6-4-12(19)10-13(14)17/h3-6,9-10,14H,7-8H2,1-2H3,(H,20,21)/t14-/m0/s1