4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[1-(furan-2-yl)ethyl]benzamide

Systemtic Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[1-(furan-2-yl)ethyl]benzamide Openeye Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[1-(2-furyl)ethyl]benzamide CAS Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[1-(2-furanyl)ethyl]benzamide IUPAC Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[1-(furan-2-yl)ethyl]benzamide Traditional Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[1-(2-furyl)ethyl]benzamide Formula: C22H22N2O4S MolecularWeight: 410.48608

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CO1)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CC(C1=CC=CO1)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C22H22N2O4S/c1-16(21-7-4-14-28-21)23-22(25)18-8-10-20(11-9-18)29(26,27)24-13-12-17-5-2-3-6-19(17)15-24/h2-11,14,16H,12-13,15H2,1H3,(H,23,25)