N-(6-bromanyl-1,3-benzothiazol-2-yl)-2,7,7-trimethyl-5-oxidanylidene-4-pyridin-3-yl-1,4,6,8-tetrahydroquinoline-3-carboxamide

Systemtic Name: N-(6-bromanyl-1,3-benzothiazol-2-yl)-2,7,7-trimethyl-5-oxidanylidene-4-pyridin-3-yl-1,4,6,8-tetrahydroquinoline-3-carboxamide Openeye Name: N-(6-bromo-1,3-benzothiazol-2-yl)-2,7,7-trimethyl-5-oxo-4-(3-pyridyl)-1,4,6,8-tetrahydroquinoline-3-carboxamide CAS Name: N-(6-bromo-1,3-benzothiazol-2-yl)-2,7,7-trimethyl-5-oxo-4-(3-pyridinyl)-1,4,6,8-tetrahydroquinoline-3-carboxamide IUPAC Name: N-(6-bromo-1,3-benzothiazol-2-yl)-2,7,7-trimethyl-5-oxo-4-pyridin-3-yl-1,4,6,8-tetrahydroquinoline-3-carboxamide Traditional Name: N-(6-bromo-1,3-benzothiazol-2-yl)-5-keto-2,7,7-trimethyl-4-(3-pyridyl)-1,4,6,8-tetrahydroquinoline-3-carboxamide Formula: C25H23BrN4O2S MolecularWeight: 523.44472

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CN=CC=C3)C(=O)NC4=NC5=C(S4)C=C(C=C5)Br

Isomeric SMILES

CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CN=CC=C3)C(=O)NC4=NC5=C(S4)C=C(C=C5)Br

InChI

InChI=1S/C25H23BrN4O2S/c1-13-20(23(32)30-24-29-16-7-6-15(26)9-19(16)33-24)21(14-5-4-8-27-12-14)22-17(28-13)10-25(2,3)11-18(22)31/h4-9,12,21,28H,10-11H2,1-3H3,(H,29,30,32)