2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-(phenylcarbamoylamino)-N-propan-2-yl-benzamide

Systemtic Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-(phenylcarbamoylamino)-N-propan-2-yl-benzamide Openeye Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-isopropyl-5-(phenylcarbamoylamino)benzamide CAS Name: 5-[[anilino(oxo)methyl]amino]-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-propan-2-ylbenzamide IUPAC Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-(phenylcarbamoylamino)-N-propan-2-ylbenzamide Traditional Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-isopropyl-5-(phenylcarbamoylamino)benzamide Formula: C26H28N4O2 MolecularWeight: 428.52612

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H28N4O2/c1-18(2)27-25(31)23-16-22(29-26(32)28-21-10-4-3-5-11-21)12-13-24(23)30-15-14-19-8-6-7-9-20(19)17-30/h3-13,16,18H,14-15,17H2,1-2H3,(H,27,31)(H2,28,29,32)