3-azanyl-6-ethoxy-N-(2-methyl-5-nitro-phenyl)thieno[2,3-b]quinoline-2-carboxamide

Systemtic Name: 3-azanyl-6-ethoxy-N-(2-methyl-5-nitro-phenyl)thieno[2,3-b]quinoline-2-carboxamide Openeye Name: 3-amino-6-ethoxy-N-(2-methyl-5-nitro-phenyl)thieno[2,3-b]quinoline-2-carboxamide CAS Name: 3-amino-6-ethoxy-N-(2-methyl-5-nitrophenyl)-2-thieno[2,3-b]quinolinecarboxamide IUPAC Name: 3-amino-6-ethoxy-N-(2-methyl-5-nitrophenyl)thieno[2,3-b]quinoline-2-carboxamide Traditional Name: 3-amino-6-ethoxy-N-(2-methyl-5-nitro-phenyl)thieno[2,3-b]quinoline-2-carboxamide Formula: C21H18N4O4S MolecularWeight: 422.45702

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=CC3=C(N=C2C=C1)SC(=C3N)C(=O)NC4=C(C=CC(=C4)[N+](=O)[O-])C

Isomeric SMILES

CCOC1=CC2=CC3=C(N=C2C=C1)SC(=C3N)C(=O)NC4=C(C=CC(=C4)[N+](=O)[O-])C

InChI

InChI=1S/C21H18N4O4S/c1-3-29-14-6-7-16-12(8-14)9-15-18(22)19(30-21(15)24-16)20(26)23-17-10-13(25(27)28)5-4-11(17)2/h4-10H,3,22H2,1-2H3,(H,23,26)