3-azanyl-N-(1,3-benzodioxol-5-yl)-6-methyl-thieno[2,3-b]quinoline-2-carboxamide

Systemtic Name: 3-azanyl-N-(1,3-benzodioxol-5-yl)-6-methyl-thieno[2,3-b]quinoline-2-carboxamide Openeye Name: 3-amino-N-(1,3-benzodioxol-5-yl)-6-methyl-thieno[2,3-b]quinoline-2-carboxamide CAS Name: 3-amino-N-(1,3-benzodioxol-5-yl)-6-methyl-2-thieno[2,3-b]quinolinecarboxamide IUPAC Name: 3-amino-N-(1,3-benzodioxol-5-yl)-6-methylthieno[2,3-b]quinoline-2-carboxamide Traditional Name: 3-amino-N-(1,3-benzodioxol-5-yl)-6-methyl-thieno[2,3-b]quinoline-2-carboxamide Formula: C20H15N3O3S MolecularWeight: 377.4164

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC3=C(N=C2C=C1)SC(=C3N)C(=O)NC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=CC2=CC3=C(N=C2C=C1)SC(=C3N)C(=O)NC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C20H15N3O3S/c1-10-2-4-14-11(6-10)7-13-17(21)18(27-20(13)23-14)19(24)22-12-3-5-15-16(8-12)26-9-25-15/h2-8H,9,21H2,1H3,(H,22,24)