5-[3-(dimethylamino)propyl]-6-oxidanylidene-N-phenyl-[1]benzothiolo[2,3-c]quinoline-9-carboxamide

Systemtic Name: 5-[3-(dimethylamino)propyl]-6-oxidanylidene-N-phenyl-[1]benzothiolo[2,3-c]quinoline-9-carboxamide Openeye Name: 5-[3-(dimethylamino)propyl]-6-oxo-N-phenyl-benzothiopheno[2,3-c]quinoline-9-carboxamide CAS Name: 5-[3-(dimethylamino)propyl]-6-oxo-N-phenyl-[1]benzothiolo[2,3-c]quinoline-9-carboxamide IUPAC Name: 5-[3-(dimethylamino)propyl]-6-oxo-N-phenyl-[1]benzothiolo[2,3-c]quinoline-9-carboxamide Traditional Name: 5-[3-(dimethylamino)propyl]-6-keto-N-phenyl-benzothiopheno[2,3-c]quinoline-9-carboxamide Formula: C27H25N3O2S MolecularWeight: 455.5713

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCN1C2=CC=CC=C2C3=C(C1=O)SC4=C3C=CC(=C4)C(=O)NC5=CC=CC=C5

Isomeric SMILES

CN(C)CCCN1C2=CC=CC=C2C3=C(C1=O)SC4=C3C=CC(=C4)C(=O)NC5=CC=CC=C5

InChI

InChI=1S/C27H25N3O2S/c1-29(2)15-8-16-30-22-12-7-6-11-20(22)24-21-14-13-18(17-23(21)33-25(24)27(30)32)26(31)28-19-9-4-3-5-10-19/h3-7,9-14,17H,8,15-16H2,1-2H3,(H,28,31)