2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[(4-ethoxyphenyl)carbamoylamino]-N-phenethyl-benzamide

Systemtic Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[(4-ethoxyphenyl)carbamoylamino]-N-phenethyl-benzamide Openeye Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[(4-ethoxyphenyl)carbamoylamino]-N-phenethyl-benzamide CAS Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[[(4-ethoxyanilino)-oxomethyl]amino]-N-phenethylbenzamide IUPAC Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[(4-ethoxyphenyl)carbamoylamino]-N-phenethylbenzamide Traditional Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-phenethyl-5-(p-phenetylcarbamoylamino)benzamide Formula: C33H34N4O3 MolecularWeight: 534.64806

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)NC2=CC(=C(C=C2)N3CCC4=CC=CC=C4C3)C(=O)NCCC5=CC=CC=C5

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)NC2=CC(=C(C=C2)N3CCC4=CC=CC=C4C3)C(=O)NCCC5=CC=CC=C5

InChI

InChI=1S/C33H34N4O3/c1-2-40-29-15-12-27(13-16-29)35-33(39)36-28-14-17-31(37-21-19-25-10-6-7-11-26(25)23-37)30(22-28)32(38)34-20-18-24-8-4-3-5-9-24/h3-17,22H,2,18-21,23H2,1H3,(H,34,38)(H2,35,36,39)