3,6-bis(azanyl)-2-ethanoyl-4-thiophen-2-yl-thieno[2,3-b]pyridin-7-ium-5-carbonitrile

Systemtic Name: 3,6-bis(azanyl)-2-ethanoyl-4-thiophen-2-yl-thieno[2,3-b]pyridin-7-ium-5-carbonitrile Openeye Name: 2-acetyl-3,6-diamino-4-(2-thienyl)thieno[2,3-b]pyridin-7-ium-5-carbonitrile CAS Name: 2-acetyl-3,6-diamino-4-thiophen-2-yl-5-thieno[2,3-b]pyridin-7-iumcarbonitrile IUPAC Name: 2-acetyl-3,6-diamino-4-thiophen-2-ylthieno[2,3-b]pyridin-7-ium-5-carbonitrile Traditional Name: 2-acetyl-3,6-diamino-4-(2-thienyl)thieno[2,3-b]pyridin-7-ium-5-carbonitrile Formula: C14H11N4OS2+ MolecularWeight: 315.39334

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C2=C(S1)[NH+]=C(C(=C2C3=CC=CS3)C#N)N)N

Isomeric SMILES

CC(=O)C1=C(C2=C(S1)[NH+]=C(C(=C2C3=CC=CS3)C#N)N)N

InChI

InChI=1S/C14H10N4OS2/c1-6(19)12-11(16)10-9(8-3-2-4-20-8)7(5-15)13(17)18-14(10)21-12/h2-4H,16H2,1H3,(H2,17,18)/p+1