3-[furan-2-ylmethyl-[3-[(3-methoxyphenyl)methyl]-1,2,4-thiadiazol-5-yl]amino]propanoate

Systemtic Name: 3-[furan-2-ylmethyl-[3-[(3-methoxyphenyl)methyl]-1,2,4-thiadiazol-5-yl]amino]propanoate Openeye Name: 3-[2-furylmethyl-[3-[(3-methoxyphenyl)methyl]-1,2,4-thiadiazol-5-yl]amino]propanoate CAS Name: 3-[2-furanylmethyl-[3-[(3-methoxyphenyl)methyl]-1,2,4-thiadiazol-5-yl]amino]propanoate IUPAC Name: 3-[furan-2-ylmethyl-[3-[(3-methoxyphenyl)methyl]-1,2,4-thiadiazol-5-yl]amino]propanoate Traditional Name: 3-[2-furfuryl-(3-m-anisyl-1,2,4-thiadiazol-5-yl)amino]propionate Formula: C18H18N3O4S- MolecularWeight: 372.41822

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CC2=NSC(=N2)N(CCC(=O)[O-])CC3=CC=CO3

Isomeric SMILES

COC1=CC=CC(=C1)CC2=NSC(=N2)N(CCC(=O)[O-])CC3=CC=CO3

InChI

InChI=1S/C18H19N3O4S/c1-24-14-5-2-4-13(10-14)11-16-19-18(26-20-16)21(8-7-17(22)23)12-15-6-3-9-25-15/h2-6,9-10H,7-8,11-12H2,1H3,(H,22,23)/p-1