[[4-(dimethylamino)-2-ethoxycarbonyl-thieno[2,3-b]pyridin-7-ium-3-yl]amino]methylidene-dimethyl-azanium

Systemtic Name: [[4-(dimethylamino)-2-ethoxycarbonyl-thieno[2,3-b]pyridin-7-ium-3-yl]amino]methylidene-dimethyl-azanium Openeye Name: [[4-(dimethylamino)-2-ethoxycarbonyl-thieno[2,3-b]pyridin-7-ium-3-yl]amino]methylene-dimethyl-ammonium CAS Name: [[4-(dimethylamino)-2-ethoxycarbonyl-3-thieno[2,3-b]pyridin-7-iumyl]amino]methylidene-dimethylammonium IUPAC Name: [[4-(dimethylamino)-2-ethoxycarbonylthieno[2,3-b]pyridin-7-ium-3-yl]amino]methylidene-dimethylazanium Traditional Name: [[2-carbethoxy-4-(dimethylamino)thieno[2,3-b]pyridin-7-ium-3-yl]amino]methylene-dimethyl-ammonium Formula: C15H22N4O2S+2 MolecularWeight: 322.42578

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(C=C[NH+]=C2S1)N(C)C)NC=[N+](C)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(C=C[NH+]=C2S1)N(C)C)NC=[N+](C)C

InChI

InChI=1S/C15H20N4O2S/c1-6-21-15(20)13-12(17-9-18(2)3)11-10(19(4)5)7-8-16-14(11)22-13/h7-9H,6H2,1-5H3/p+2