N-butan-2-yl-2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[(2,6-dimethylphenyl)carbamoylamino]benzamide

Systemtic Name: N-butan-2-yl-2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[(2,6-dimethylphenyl)carbamoylamino]benzamide Openeye Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[(2,6-dimethylphenyl)carbamoylamino]-N-sec-butyl-benzamide CAS Name: N-butan-2-yl-2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[[(2,6-dimethylanilino)-oxomethyl]amino]benzamide IUPAC Name: N-butan-2-yl-2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[(2,6-dimethylphenyl)carbamoylamino]benzamide Traditional Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[(2,6-dimethylphenyl)carbamoylamino]-N-sec-butyl-benzamide Formula: C29H34N4O2 MolecularWeight: 470.60586

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=C(C=CC(=C1)NC(=O)NC2=C(C=CC=C2C)C)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CCC(C)NC(=O)C1=C(C=CC(=C1)NC(=O)NC2=C(C=CC=C2C)C)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C29H34N4O2/c1-5-21(4)30-28(34)25-17-24(31-29(35)32-27-19(2)9-8-10-20(27)3)13-14-26(25)33-16-15-22-11-6-7-12-23(22)18-33/h6-14,17,21H,5,15-16,18H2,1-4H3,(H,30,34)(H2,31,32,35)