2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-(naphthalen-1-ylcarbamoylamino)-N-phenethyl-benzamide

Systemtic Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-(naphthalen-1-ylcarbamoylamino)-N-phenethyl-benzamide Openeye Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-(1-naphthylcarbamoylamino)-N-phenethyl-benzamide CAS Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[[(1-naphthalenylamino)-oxomethyl]amino]-N-phenethylbenzamide IUPAC Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-(naphthalen-1-ylcarbamoylamino)-N-phenethylbenzamide Traditional Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-(1-naphthylcarbamoylamino)-N-phenethyl-benzamide Formula: C35H32N4O2 MolecularWeight: 540.65418

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C3=C(C=C(C=C3)NC(=O)NC4=CC=CC5=CC=CC=C54)C(=O)NCCC6=CC=CC=C6

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C3=C(C=C(C=C3)NC(=O)NC4=CC=CC5=CC=CC=C54)C(=O)NCCC6=CC=CC=C6

InChI

InChI=1S/C35H32N4O2/c40-34(36-21-19-25-9-2-1-3-10-25)31-23-29(17-18-33(31)39-22-20-26-11-4-5-13-28(26)24-39)37-35(41)38-32-16-8-14-27-12-6-7-15-30(27)32/h1-18,23H,19-22,24H2,(H,36,40)(H2,37,38,41)