3-[[(4-aminocarbonylphenyl)carbamoylamino]methyl]-N-(1,2,3,4-tetrahydroisoquinolin-7-yl)benzamide

Systemtic Name: 3-[[(4-aminocarbonylphenyl)carbamoylamino]methyl]-N-(1,2,3,4-tetrahydroisoquinolin-7-yl)benzamide Openeye Name: 3-[[(4-carbamoylphenyl)carbamoylamino]methyl]-N-(1,2,3,4-tetrahydroisoquinolin-7-yl)benzamide CAS Name: 3-[[[(4-carbamoylanilino)-oxomethyl]amino]methyl]-N-(1,2,3,4-tetrahydroisoquinolin-7-yl)benzamide IUPAC Name: 3-[[(4-carbamoylphenyl)carbamoylamino]methyl]-N-(1,2,3,4-tetrahydroisoquinolin-7-yl)benzamide Traditional Name: 3-[[(4-carbamoylphenyl)carbamoylamino]methyl]-N-(1,2,3,4-tetrahydroisoquinolin-7-yl)benzamide Formula: C25H25N5O3 MolecularWeight: 443.4977

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCC2=C1C=CC(=C2)NC(=O)C3=CC(=CC=C3)CNC(=O)NC4=CC=C(C=C4)C(=O)N

Isomeric SMILES

C1CNCC2=C1C=CC(=C2)NC(=O)C3=CC(=CC=C3)CNC(=O)NC4=CC=C(C=C4)C(=O)N

InChI

InChI=1S/C25H25N5O3/c26-23(31)18-5-7-21(8-6-18)30-25(33)28-14-16-2-1-3-19(12-16)24(32)29-22-9-4-17-10-11-27-15-20(17)13-22/h1-9,12-13,27H,10-11,14-15H2,(H2,26,31)(H,29,32)(H2,28,30,33)