2-[[furan-2-ylmethyl-[(3-methylthiophen-2-yl)methyl]amino]methyl]-1,3-oxazole-4-carboxylic acid

Systemtic Name: 2-[[furan-2-ylmethyl-[(3-methylthiophen-2-yl)methyl]amino]methyl]-1,3-oxazole-4-carboxylic acid Openeye Name: 2-[[2-furylmethyl-[(3-methyl-2-thienyl)methyl]amino]methyl]oxazole-4-carboxylic acid CAS Name: 2-[[2-furanylmethyl-[(3-methyl-2-thiophenyl)methyl]amino]methyl]-4-oxazolecarboxylic acid IUPAC Name: 2-[[furan-2-ylmethyl-[(3-methylthiophen-2-yl)methyl]amino]methyl]-1,3-oxazole-4-carboxylic acid Traditional Name: 2-[[2-furfuryl-[(3-methyl-2-thienyl)methyl]amino]methyl]oxazole-4-carboxylic acid Formula: C16H16N2O4S MolecularWeight: 332.37424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)CN(CC2=CC=CO2)CC3=NC(=CO3)C(=O)O

Isomeric SMILES

CC1=C(SC=C1)CN(CC2=CC=CO2)CC3=NC(=CO3)C(=O)O

InChI

InChI=1S/C16H16N2O4S/c1-11-4-6-23-14(11)8-18(7-12-3-2-5-21-12)9-15-17-13(10-22-15)16(19)20/h2-6,10H,7-9H2,1H3,(H,19,20)