3-azanyl-6,7-dimethyl-N-[(4-methylphenyl)methyl]thieno[2,3-b]quinoline-2-carboxamide

Systemtic Name: 3-azanyl-6,7-dimethyl-N-[(4-methylphenyl)methyl]thieno[2,3-b]quinoline-2-carboxamide Openeye Name: 3-amino-6,7-dimethyl-N-(p-tolylmethyl)thieno[2,3-b]quinoline-2-carboxamide CAS Name: 3-amino-6,7-dimethyl-N-[(4-methylphenyl)methyl]-2-thieno[2,3-b]quinolinecarboxamide IUPAC Name: 3-amino-6,7-dimethyl-N-[(4-methylphenyl)methyl]thieno[2,3-b]quinoline-2-carboxamide Traditional Name: 3-amino-6,7-dimethyl-N-(4-methylbenzyl)thieno[2,3-b]quinoline-2-carboxamide Formula: C22H21N3OS MolecularWeight: 375.48664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C2=C(C3=C(S2)N=C4C=C(C(=CC4=C3)C)C)N

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)C2=C(C3=C(S2)N=C4C=C(C(=CC4=C3)C)C)N

InChI

InChI=1S/C22H21N3OS/c1-12-4-6-15(7-5-12)11-24-21(26)20-19(23)17-10-16-8-13(2)14(3)9-18(16)25-22(17)27-20/h4-10H,11,23H2,1-3H3,(H,24,26)