N-(3,4-dihydro-2H-chromen-4-yl)-2-ethylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: N-(3,4-dihydro-2H-chromen-4-yl)-2-ethylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: N-chroman-4-yl-2-ethylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: N-(3,4-dihydro-2H-1-benzopyran-4-yl)-2-ethylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: N-(3,4-dihydro-2H-chromen-4-yl)-2-ethylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: N-chroman-4-yl-2-esyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C21H24N2O4S MolecularWeight: 400.49126

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CC2=CC=CC=C2CC1C(=O)NC3CCOC4=CC=CC=C34

Isomeric SMILES

CCS(=O)(=O)N1CC2=CC=CC=C2CC1C(=O)NC3CCOC4=CC=CC=C34

InChI

InChI=1S/C21H24N2O4S/c1-2-28(25,26)23-14-16-8-4-3-7-15(16)13-19(23)21(24)22-18-11-12-27-20-10-6-5-9-17(18)20/h3-10,18-19H,2,11-14H2,1H3,(H,22,24)