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

Systemtic Name: N-butan-2-yl-2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[(4-methylphenyl)carbamoylamino]benzamide Openeye Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-(p-tolylcarbamoylamino)-N-sec-butyl-benzamide CAS Name: N-butan-2-yl-2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[[(4-methylanilino)-oxomethyl]amino]benzamide IUPAC Name: N-butan-2-yl-2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[(4-methylphenyl)carbamoylamino]benzamide Traditional Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-(p-tolylcarbamoylamino)-N-sec-butyl-benzamide Formula: C28H32N4O2 MolecularWeight: 456.57928

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H32N4O2/c1-4-20(3)29-27(33)25-17-24(31-28(34)30-23-11-9-19(2)10-12-23)13-14-26(25)32-16-15-21-7-5-6-8-22(21)18-32/h5-14,17,20H,4,15-16,18H2,1-3H3,(H,29,33)(H2,30,31,34)