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N-[bis(azanyl)methylidene]-4-cyano-1-benzothiophene-2-carboxamide; methanesulfonic acid

N-[bis(azanyl)methylidene]-4-cyano-1-benzothiophene-2-carboxamide; methanesulfonic acid

Systemtic Name:N-[bis(azanyl)methylidene]-4-cyano-1-benzothiophene-2-carboxamide; methanesulfonic acid
Openeye Name:4-cyano-N-(diaminomethylene)benzothiophene-2-carboxamide; methanesulfonic acid
CAS Name:4-cyano-N-(diaminomethylidene)-1-benzothiophene-2-carboxamide; methanesulfonic acid
IUPAC Name:4-cyano-N-(diaminomethylidene)-1-benzothiophene-2-carboxamide; methanesulfonic acid
Traditional Name:4-cyano-N-(diaminomethylene)benzothiophene-2-carboxamide; mesylic acid
Formula: C12H12N4O4S2
MolecularWeight: 340.37808
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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)O.C1=CC(=C2C=C(SC2=C1)C(=O)N=C(N)N)C#N


Isomeric SMILES

CS(=O)(=O)O.C1=CC(=C2C=C(SC2=C1)C(=O)N=C(N)N)C#N


InChI

InChI=1S/C11H8N4OS.CH4O3S/c12-5-6-2-1-3-8-7(6)4-9(17-8)10(16)15-11(13)14;1-5(2,3)4/h1-4H,(H4,13,14,15,16);1H3,(H,2,3,4)


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