3-azanyl-N-[(4-butoxyphenyl)methyl]-7-methoxy-thieno[2,3-b]quinoline-2-carboxamide

Systemtic Name: 3-azanyl-N-[(4-butoxyphenyl)methyl]-7-methoxy-thieno[2,3-b]quinoline-2-carboxamide Openeye Name: 3-amino-N-[(4-butoxyphenyl)methyl]-7-methoxy-thieno[2,3-b]quinoline-2-carboxamide CAS Name: 3-amino-N-[(4-butoxyphenyl)methyl]-7-methoxy-2-thieno[2,3-b]quinolinecarboxamide IUPAC Name: 3-amino-N-[(4-butoxyphenyl)methyl]-7-methoxythieno[2,3-b]quinoline-2-carboxamide Traditional Name: 3-amino-N-(4-butoxybenzyl)-7-methoxy-thieno[2,3-b]quinoline-2-carboxamide Formula: C24H25N3O3S MolecularWeight: 435.5386

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)CNC(=O)C2=C(C3=C(S2)N=C4C=C(C=CC4=C3)OC)N

Isomeric SMILES

CCCCOC1=CC=C(C=C1)CNC(=O)C2=C(C3=C(S2)N=C4C=C(C=CC4=C3)OC)N

InChI

InChI=1S/C24H25N3O3S/c1-3-4-11-30-17-8-5-15(6-9-17)14-26-23(28)22-21(25)19-12-16-7-10-18(29-2)13-20(16)27-24(19)31-22/h5-10,12-13H,3-4,11,14,25H2,1-2H3,(H,26,28)