1-benzothiophen-6-yl 2-carbamimidoylbenzoate

Systemtic Name: 1-benzothiophen-6-yl 2-carbamimidoylbenzoate Openeye Name: benzothiophen-6-yl 2-carbamimidoylbenzoate CAS Name: 2-carbamimidoylbenzoic acid 1-benzothiophen-6-yl ester IUPAC Name: 1-benzothiophen-6-yl 2-carbamimidoylbenzoate Traditional Name: 2-amidinobenzoic acid benzothiophen-6-yl ester Formula: C16H12N2O2S MolecularWeight: 296.34368

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=N)N)C(=O)OC2=CC3=C(C=C2)C=CS3

Isomeric SMILES

C1=CC=C(C(=C1)C(=N)N)C(=O)OC2=CC3=C(C=C2)C=CS3

InChI

InChI=1S/C16H12N2O2S/c17-15(18)12-3-1-2-4-13(12)16(19)20-11-6-5-10-7-8-21-14(10)9-11/h1-9H,(H3,17,18)