3,6-bis(azanyl)-2-naphthalen-2-ylcarbonyl-thieno[2,3-b]pyridin-7-ium-5-carbonitrile

Systemtic Name: 3,6-bis(azanyl)-2-naphthalen-2-ylcarbonyl-thieno[2,3-b]pyridin-7-ium-5-carbonitrile Openeye Name: 3,6-diamino-2-(naphthalene-2-carbonyl)thieno[2,3-b]pyridin-7-ium-5-carbonitrile CAS Name: 3,6-diamino-2-[2-naphthalenyl(oxo)methyl]-5-thieno[2,3-b]pyridin-7-iumcarbonitrile IUPAC Name: 3,6-diamino-2-(naphthalene-2-carbonyl)thieno[2,3-b]pyridin-7-ium-5-carbonitrile Traditional Name: 3,6-diamino-2-(2-naphthoyl)thieno[2,3-b]pyridin-7-ium-5-carbonitrile Formula: C19H13N4OS+ MolecularWeight: 345.39772

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)C(=O)C3=C(C4=C(S3)[NH+]=C(C(=C4)C#N)N)N

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)C(=O)C3=C(C4=C(S3)[NH+]=C(C(=C4)C#N)N)N

InChI

InChI=1S/C19H12N4OS/c20-9-13-8-14-15(21)17(25-19(14)23-18(13)22)16(24)12-6-5-10-3-1-2-4-11(10)7-12/h1-8H,21H2,(H2,22,23)/p+1