3-azanyl-N-(5-bromanyl-1,3-benzothiazol-2-yl)-6-ethyl-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxamide

Systemtic Name: 3-azanyl-N-(5-bromanyl-1,3-benzothiazol-2-yl)-6-ethyl-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxamide Openeye Name: 3-amino-N-(5-bromo-1,3-benzothiazol-2-yl)-6-ethyl-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxamide CAS Name: 3-amino-N-(5-bromo-1,3-benzothiazol-2-yl)-6-ethyl-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxamide IUPAC Name: 3-amino-N-(5-bromo-1,3-benzothiazol-2-yl)-6-ethyl-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxamide Traditional Name: 3-amino-N-(5-bromo-1,3-benzothiazol-2-yl)-6-ethyl-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxamide Formula: C21H19BrN4OS2 MolecularWeight: 487.43576

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC2=C(C1)C=C3C(=C(SC3=N2)C(=O)NC4=NC5=C(S4)C=CC(=C5)Br)N

Isomeric SMILES

CCC1CCC2=C(C1)C=C3C(=C(SC3=N2)C(=O)NC4=NC5=C(S4)C=CC(=C5)Br)N

InChI

InChI=1S/C21H19BrN4OS2/c1-2-10-3-5-14-11(7-10)8-13-17(23)18(29-20(13)24-14)19(27)26-21-25-15-9-12(22)4-6-16(15)28-21/h4,6,8-10H,2-3,5,7,23H2,1H3,(H,25,26,27)