3-azanyl-N-(1,3-benzodioxol-5-ylmethyl)-5-oxidanylidene-7,8-dihydro-6H-thieno[2,3-b]quinoline-2-carboxamide

Systemtic Name: 3-azanyl-N-(1,3-benzodioxol-5-ylmethyl)-5-oxidanylidene-7,8-dihydro-6H-thieno[2,3-b]quinoline-2-carboxamide Openeye Name: 3-amino-N-(1,3-benzodioxol-5-ylmethyl)-5-oxo-7,8-dihydro-6H-thieno[2,3-b]quinoline-2-carboxamide CAS Name: 3-amino-N-(1,3-benzodioxol-5-ylmethyl)-5-oxo-7,8-dihydro-6H-thieno[2,3-b]quinoline-2-carboxamide IUPAC Name: 3-amino-N-(1,3-benzodioxol-5-ylmethyl)-5-oxo-7,8-dihydro-6H-thieno[2,3-b]quinoline-2-carboxamide Traditional Name: 3-amino-5-keto-N-piperonyl-7,8-dihydro-6H-thieno[2,3-b]quinoline-2-carboxamide Formula: C20H17N3O4S MolecularWeight: 395.43168

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=C3C(=C(SC3=N2)C(=O)NCC4=CC5=C(C=C4)OCO5)N)C(=O)C1

Isomeric SMILES

C1CC2=C(C=C3C(=C(SC3=N2)C(=O)NCC4=CC5=C(C=C4)OCO5)N)C(=O)C1

InChI

InChI=1S/C20H17N3O4S/c21-17-12-7-11-13(2-1-3-14(11)24)23-20(12)28-18(17)19(25)22-8-10-4-5-15-16(6-10)27-9-26-15/h4-7H,1-3,8-9,21H2,(H,22,25)