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

Systemtic Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[(4-ethylphenyl)carbonylamino]-N-propan-2-yl-benzamide Openeye Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[(4-ethylbenzoyl)amino]-N-isopropyl-benzamide CAS Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[[(4-ethylphenyl)-oxomethyl]amino]-N-propan-2-ylbenzamide IUPAC Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[(4-ethylbenzoyl)amino]-N-propan-2-ylbenzamide Traditional Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[(4-ethylbenzoyl)amino]-N-isopropyl-benzamide Formula: C28H31N3O2 MolecularWeight: 441.56464

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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)NC(C)C

Isomeric SMILES

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

InChI

InChI=1S/C28H31N3O2/c1-4-20-9-11-22(12-10-20)27(32)30-24-13-14-26(25(17-24)28(33)29-19(2)3)31-16-15-21-7-5-6-8-23(21)18-31/h5-14,17,19H,4,15-16,18H2,1-3H3,(H,29,33)(H,30,32)