[3-azanyl-4-(dimethylamino)thieno[2,3-b]pyridin-7-ium-2-yl]-(4-methoxyphenyl)methanone

Systemtic Name: [3-azanyl-4-(dimethylamino)thieno[2,3-b]pyridin-7-ium-2-yl]-(4-methoxyphenyl)methanone Openeye Name: [3-amino-4-(dimethylamino)thieno[2,3-b]pyridin-7-ium-2-yl]-(4-methoxyphenyl)methanone CAS Name: [3-amino-4-(dimethylamino)-2-thieno[2,3-b]pyridin-7-iumyl]-(4-methoxyphenyl)methanone IUPAC Name: [3-amino-4-(dimethylamino)thieno[2,3-b]pyridin-7-ium-2-yl]-(4-methoxyphenyl)methanone Traditional Name: [3-amino-4-(dimethylamino)thieno[2,3-b]pyridin-7-ium-2-yl]-(4-methoxyphenyl)methanone Formula: C17H18N3O2S+ MolecularWeight: 328.40872

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C2C(=C(SC2=[NH+]C=C1)C(=O)C3=CC=C(C=C3)OC)N

Isomeric SMILES

CN(C)C1=C2C(=C(SC2=[NH+]C=C1)C(=O)C3=CC=C(C=C3)OC)N

InChI

InChI=1S/C17H17N3O2S/c1-20(2)12-8-9-19-17-13(12)14(18)16(23-17)15(21)10-4-6-11(22-3)7-5-10/h4-9H,18H2,1-3H3/p+1