1-benzothiophen-6-yl (E)-2-carbamimidoylpent-2-enoate

Systemtic Name: 1-benzothiophen-6-yl (E)-2-carbamimidoylpent-2-enoate Openeye Name: benzothiophen-6-yl (E)-2-carbamimidoylpent-2-enoate CAS Name: (E)-2-carbamimidoyl-2-pentenoic acid 1-benzothiophen-6-yl ester IUPAC Name: 1-benzothiophen-6-yl (E)-2-carbamimidoylpent-2-enoate Traditional Name: (E)-2-amidinopent-2-enoic acid benzothiophen-6-yl ester Formula: C14H14N2O2S MolecularWeight: 274.33816

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Descriptors Computed from Structure

Canonical SMILES:

CCC=C(C(=N)N)C(=O)OC1=CC2=C(C=C1)C=CS2

Isomeric SMILES

CC/C=C(\C(=N)N)/C(=O)OC1=CC2=C(C=C1)C=CS2

InChI

InChI=1S/C14H14N2O2S/c1-2-3-11(13(15)16)14(17)18-10-5-4-9-6-7-19-12(9)8-10/h3-8H,2H2,1H3,(H3,15,16)/b11-3+