N-butan-2-yl-5-[(3-chloranyl-2,2-dimethyl-propanoyl)amino]-2-(3,4-dihydro-1H-isoquinolin-2-yl)benzamide

Systemtic Name: N-butan-2-yl-5-[(3-chloranyl-2,2-dimethyl-propanoyl)amino]-2-(3,4-dihydro-1H-isoquinolin-2-yl)benzamide Openeye Name: 5-[(3-chloro-2,2-dimethyl-propanoyl)amino]-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-sec-butyl-benzamide CAS Name: N-butan-2-yl-5-[(3-chloro-2,2-dimethyl-1-oxopropyl)amino]-2-(3,4-dihydro-1H-isoquinolin-2-yl)benzamide IUPAC Name: N-butan-2-yl-5-[(3-chloro-2,2-dimethylpropanoyl)amino]-2-(3,4-dihydro-1H-isoquinolin-2-yl)benzamide Traditional Name: 5-[(3-chloro-2,2-dimethyl-propanoyl)amino]-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-sec-butyl-benzamide Formula: C25H32ClN3O2 MolecularWeight: 441.99348

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=C(C=CC(=C1)NC(=O)C(C)(C)CCl)N2CCC3=CC=CC=C3C2

Isomeric SMILES

CCC(C)NC(=O)C1=C(C=CC(=C1)NC(=O)C(C)(C)CCl)N2CCC3=CC=CC=C3C2

InChI

InChI=1S/C25H32ClN3O2/c1-5-17(2)27-23(30)21-14-20(28-24(31)25(3,4)16-26)10-11-22(21)29-13-12-18-8-6-7-9-19(18)15-29/h6-11,14,17H,5,12-13,15-16H2,1-4H3,(H,27,30)(H,28,31)