6-methyl-2-[(3-nitrophenyl)methylideneamino]-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-6-ium-3-carboxamide

Systemtic Name: 6-methyl-2-[(3-nitrophenyl)methylideneamino]-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-6-ium-3-carboxamide Openeye Name: 6-methyl-2-[(3-nitrophenyl)methyleneamino]-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-6-ium-3-carboxamide CAS Name: 6-methyl-2-[(3-nitrophenyl)methylideneamino]-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-6-ium-3-carboxamide IUPAC Name: 6-methyl-2-[(3-nitrophenyl)methylideneamino]-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-6-ium-3-carboxamide Traditional Name: 6-methyl-2-[(3-nitrobenzylidene)amino]-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-6-ium-3-carboxamide Formula: C16H17N4O3S+ MolecularWeight: 345.39618

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC2=C(C1)SC(=C2C(=O)N)N=CC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C[NH+]1CCC2=C(C1)SC(=C2C(=O)N)N=CC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H16N4O3S/c1-19-6-5-12-13(9-19)24-16(14(12)15(17)21)18-8-10-3-2-4-11(7-10)20(22)23/h2-4,7-8H,5-6,9H2,1H3,(H2,17,21)/p+1