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

Systemtic Name: N-[bis(azanyl)methylidene]-4-methoxy-1-benzothiophene-2-carboxamide; methanesulfonic acid Openeye Name: N-(diaminomethylene)-4-methoxy-benzothiophene-2-carboxamide; methanesulfonic acid CAS Name: N-(diaminomethylidene)-4-methoxy-1-benzothiophene-2-carboxamide; methanesulfonic acid IUPAC Name: N-(diaminomethylidene)-4-methoxy-1-benzothiophene-2-carboxamide; methanesulfonic acid Traditional Name: N-(diaminomethylene)-4-methoxy-benzothiophene-2-carboxamide; mesylic acid Formula: C12H15N3O5S2 MolecularWeight: 345.3946

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C=C(SC2=CC=C1)C(=O)N=C(N)N.CS(=O)(=O)O

Isomeric SMILES

COC1=C2C=C(SC2=CC=C1)C(=O)N=C(N)N.CS(=O)(=O)O

InChI

InChI=1S/C11H11N3O2S.CH4O3S/c1-16-7-3-2-4-8-6(7)5-9(17-8)10(15)14-11(12)13;1-5(2,3)4/h2-5H,1H3,(H4,12,13,14,15);1H3,(H,2,3,4)