2-[3-[2-(5-carbamimidoyl-2-methylsulfanyl-thiophen-3-yl)-1,3-thiazol-4-yl]phenoxy]ethanoic acid

Systemtic Name: 2-[3-[2-(5-carbamimidoyl-2-methylsulfanyl-thiophen-3-yl)-1,3-thiazol-4-yl]phenoxy]ethanoic acid Openeye Name: 2-[3-[2-(5-carbamimidoyl-2-methylsulfanyl-3-thienyl)thiazol-4-yl]phenoxy]acetic acid CAS Name: 2-[3-[2-[5-carbamimidoyl-2-(methylthio)-3-thiophenyl]-4-thiazolyl]phenoxy]acetic acid IUPAC Name: 2-[3-[2-(5-carbamimidoyl-2-methylsulfanylthiophen-3-yl)-1,3-thiazol-4-yl]phenoxy]acetic acid Traditional Name: 2-[3-[2-[5-amidino-2-(methylthio)-3-thienyl]thiazol-4-yl]phenoxy]acetic acid Formula: C17H15N3O3S3 MolecularWeight: 405.5143

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=C(S1)C(=N)N)C2=NC(=CS2)C3=CC(=CC=C3)OCC(=O)O

Isomeric SMILES

CSC1=C(C=C(S1)C(=N)N)C2=NC(=CS2)C3=CC(=CC=C3)OCC(=O)O

InChI

InChI=1S/C17H15N3O3S3/c1-24-17-11(6-13(26-17)15(18)19)16-20-12(8-25-16)9-3-2-4-10(5-9)23-7-14(21)22/h2-6,8H,7H2,1H3,(H3,18,19)(H,21,22)