carbamimidoyl 3-(1-benzothiophen-6-yl)furan-2-carboxylate; methanesulfonic acid

Systemtic Name: carbamimidoyl 3-(1-benzothiophen-6-yl)furan-2-carboxylate; methanesulfonic acid Openeye Name: carbamimidoyl 3-(benzothiophen-6-yl)furan-2-carboxylate; methanesulfonic acid CAS Name: 3-(1-benzothiophen-6-yl)-2-furancarboxylic acid carbamimidoyl ester; methanesulfonic acid IUPAC Name: carbamimidoyl 3-(1-benzothiophen-6-yl)furan-2-carboxylate; methanesulfonic acid Traditional Name: 3-(benzothiophen-6-yl)furan-2-carboxylic acid amidino ester; mesylic acid Formula: C15H14N2O6S2 MolecularWeight: 382.41146

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)O.C1=CC(=CC2=C1C=CS2)C3=C(OC=C3)C(=O)OC(=N)N

Isomeric SMILES

CS(=O)(=O)O.C1=CC(=CC2=C1C=CS2)C3=C(OC=C3)C(=O)OC(=N)N

InChI

InChI=1S/C14H10N2O3S.CH4O3S/c15-14(16)19-13(17)12-10(3-5-18-12)9-2-1-8-4-6-20-11(8)7-9;1-5(2,3)4/h1-7H,(H3,15,16);1H3,(H,2,3,4)