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

Systemtic Name: 3-azanyl-N-(1,3-benzodioxol-5-ylmethyl)-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxamide Openeye Name: 3-amino-N-(1,3-benzodioxol-5-ylmethyl)-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxamide CAS Name: 3-amino-N-(1,3-benzodioxol-5-ylmethyl)-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxamide IUPAC Name: 3-amino-N-(1,3-benzodioxol-5-ylmethyl)-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxamide Traditional Name: 3-amino-N-piperonyl-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxamide Formula: C20H19N3O3S MolecularWeight: 381.44816

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=C3C(=C(SC3=N2)C(=O)NCC4=CC5=C(C=C4)OCO5)N

Isomeric SMILES

C1CCC2=C(C1)C=C3C(=C(SC3=N2)C(=O)NCC4=CC5=C(C=C4)OCO5)N

InChI

InChI=1S/C20H19N3O3S/c21-17-13-8-12-3-1-2-4-14(12)23-20(13)27-18(17)19(24)22-9-11-5-6-15-16(7-11)26-10-25-15/h5-8H,1-4,9-10,21H2,(H,22,24)