3-azanyl-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-7-methyl-thieno[2,3-b]quinoline-2-carboxamide

Systemtic Name: 3-azanyl-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-7-methyl-thieno[2,3-b]quinoline-2-carboxamide Openeye Name: 3-amino-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-7-methyl-thieno[2,3-b]quinoline-2-carboxamide CAS Name: 3-amino-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-7-methyl-2-thieno[2,3-b]quinolinecarboxamide IUPAC Name: 3-amino-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-7-methylthieno[2,3-b]quinoline-2-carboxamide Traditional Name: 3-amino-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-7-methyl-thieno[2,3-b]quinoline-2-carboxamide Formula: C21H17N3O3S MolecularWeight: 391.44298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NC3=C(C=C2C=C1)C(=C(S3)C(=O)NC4=CC5=C(C=C4)OCCO5)N

Isomeric SMILES

CC1=CC2=NC3=C(C=C2C=C1)C(=C(S3)C(=O)NC4=CC5=C(C=C4)OCCO5)N

InChI

InChI=1S/C21H17N3O3S/c1-11-2-3-12-9-14-18(22)19(28-21(14)24-15(12)8-11)20(25)23-13-4-5-16-17(10-13)27-7-6-26-16/h2-5,8-10H,6-7,22H2,1H3,(H,23,25)