(4R)-N-(5-bromanylpyridin-2-yl)-2,7,7-trimethyl-5-oxidanylidene-4-thiophen-3-yl-1,4,6,8-tetrahydroquinoline-3-carboxamide

Systemtic Name: (4R)-N-(5-bromanylpyridin-2-yl)-2,7,7-trimethyl-5-oxidanylidene-4-thiophen-3-yl-1,4,6,8-tetrahydroquinoline-3-carboxamide Openeye Name: (4R)-N-(5-bromo-2-pyridyl)-2,7,7-trimethyl-5-oxo-4-(3-thienyl)-1,4,6,8-tetrahydroquinoline-3-carboxamide CAS Name: (4R)-N-(5-bromo-2-pyridinyl)-2,7,7-trimethyl-5-oxo-4-(3-thiophenyl)-1,4,6,8-tetrahydroquinoline-3-carboxamide IUPAC Name: (4R)-N-(5-bromopyridin-2-yl)-2,7,7-trimethyl-5-oxo-4-thiophen-3-yl-1,4,6,8-tetrahydroquinoline-3-carboxamide Traditional Name: (4R)-N-(5-bromo-2-pyridyl)-5-keto-2,7,7-trimethyl-4-(3-thienyl)-1,4,6,8-tetrahydroquinoline-3-carboxamide Formula: C22H22BrN3O2S MolecularWeight: 472.39798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CSC=C3)C(=O)NC4=NC=C(C=C4)Br

Isomeric SMILES

CC1=C([C@@H](C2=C(N1)CC(CC2=O)(C)C)C3=CSC=C3)C(=O)NC4=NC=C(C=C4)Br

InChI

InChI=1S/C22H22BrN3O2S/c1-12-18(21(28)26-17-5-4-14(23)10-24-17)19(13-6-7-29-11-13)20-15(25-12)8-22(2,3)9-16(20)27/h4-7,10-11,19,25H,8-9H2,1-3H3,(H,24,26,28)/t19-/m0/s1