N-[4-bromanyl-2-[(5-chloranylpyridin-2-yl)carbamoyl]phenyl]-2-methyl-3,4-dihydro-1H-isoquinoline-6-carboxamide

Systemtic Name: N-[4-bromanyl-2-[(5-chloranylpyridin-2-yl)carbamoyl]phenyl]-2-methyl-3,4-dihydro-1H-isoquinoline-6-carboxamide Openeye Name: N-[4-bromo-2-[(5-chloro-2-pyridyl)carbamoyl]phenyl]-2-methyl-3,4-dihydro-1H-isoquinoline-6-carboxamide CAS Name: N-[4-bromo-2-[[(5-chloro-2-pyridinyl)amino]-oxomethyl]phenyl]-2-methyl-3,4-dihydro-1H-isoquinoline-6-carboxamide IUPAC Name: N-[4-bromo-2-[(5-chloropyridin-2-yl)carbamoyl]phenyl]-2-methyl-3,4-dihydro-1H-isoquinoline-6-carboxamide Traditional Name: N-[4-bromo-2-[(5-chloro-2-pyridyl)carbamoyl]phenyl]-2-methyl-3,4-dihydro-1H-isoquinoline-6-carboxamide Formula: C23H20BrClN4O2 MolecularWeight: 499.7875

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC2=C(C1)C=CC(=C2)C(=O)NC3=C(C=C(C=C3)Br)C(=O)NC4=NC=C(C=C4)Cl

Isomeric SMILES

CN1CCC2=C(C1)C=CC(=C2)C(=O)NC3=C(C=C(C=C3)Br)C(=O)NC4=NC=C(C=C4)Cl

InChI

InChI=1S/C23H20BrClN4O2/c1-29-9-8-14-10-15(2-3-16(14)13-29)22(30)27-20-6-4-17(24)11-19(20)23(31)28-21-7-5-18(25)12-26-21/h2-7,10-12H,8-9,13H2,1H3,(H,27,30)(H,26,28,31)