ethyl 3-azanyl-4-(phenylcarbonyl)-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxylate

Systemtic Name: ethyl 3-azanyl-4-(phenylcarbonyl)-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxylate Openeye Name: ethyl 3-amino-4-benzoyl-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxylate CAS Name: 3-amino-4-benzoyl-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-amino-4-benzoyl-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxylate Traditional Name: 3-amino-4-benzoyl-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxylic acid ethyl ester Formula: C21H20N2O3S MolecularWeight: 380.4601

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(C3=C(CCCC3)N=C2S1)C(=O)C4=CC=CC=C4)N

Isomeric SMILES

CCOC(=O)C1=C(C2=C(C3=C(CCCC3)N=C2S1)C(=O)C4=CC=CC=C4)N

InChI

InChI=1S/C21H20N2O3S/c1-2-26-21(25)19-17(22)16-15(18(24)12-8-4-3-5-9-12)13-10-6-7-11-14(13)23-20(16)27-19/h3-5,8-9H,2,6-7,10-11,22H2,1H3