4-chloranyl-N-[4-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)-4-oxidanylidene-butyl]benzamide

Systemtic Name: 4-chloranyl-N-[4-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)-4-oxidanylidene-butyl]benzamide Openeye Name: 4-chloro-N-[4-[6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinolin-2-yl]-4-oxo-butyl]benzamide CAS Name: 4-chloro-N-[4-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)-4-oxobutyl]benzamide IUPAC Name: 4-chloro-N-[4-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)-4-oxobutyl]benzamide Traditional Name: 4-chloro-N-[4-[6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinolin-2-yl]-4-keto-butyl]benzamide Formula: C26H27ClN2O4S MolecularWeight: 499.02158

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(N(CCC2=C1)C(=O)CCCNC(=O)C3=CC=C(C=C3)Cl)C4=CC=CS4)OC

Isomeric SMILES

COC1=C(C=C2C(N(CCC2=C1)C(=O)CCCNC(=O)C3=CC=C(C=C3)Cl)C4=CC=CS4)OC

InChI

InChI=1S/C26H27ClN2O4S/c1-32-21-15-18-11-13-29(25(23-5-4-14-34-23)20(18)16-22(21)33-2)24(30)6-3-12-28-26(31)17-7-9-19(27)10-8-17/h4-5,7-10,14-16,25H,3,6,11-13H2,1-2H3,(H,28,31)