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

Systemtic Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[(4-ethylphenyl)carbonylamino]-N-phenethyl-benzamide Openeye Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[(4-ethylbenzoyl)amino]-N-phenethyl-benzamide CAS Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[[(4-ethylphenyl)-oxomethyl]amino]-N-phenethylbenzamide IUPAC Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[(4-ethylbenzoyl)amino]-N-phenethylbenzamide Traditional Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[(4-ethylbenzoyl)amino]-N-phenethyl-benzamide Formula: C33H33N3O2 MolecularWeight: 503.63402

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2)N3CCC4=CC=CC=C4C3)C(=O)NCCC5=CC=CC=C5

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2)N3CCC4=CC=CC=C4C3)C(=O)NCCC5=CC=CC=C5

InChI

InChI=1S/C33H33N3O2/c1-2-24-12-14-27(15-13-24)32(37)35-29-16-17-31(36-21-19-26-10-6-7-11-28(26)23-36)30(22-29)33(38)34-20-18-25-8-4-3-5-9-25/h3-17,22H,2,18-21,23H2,1H3,(H,34,38)(H,35,37)