3-[furan-3-ylmethyl(thiophen-3-ylmethyl)amino]-1H-pyrazole-5-carboxylic acid

Systemtic Name: 3-[furan-3-ylmethyl(thiophen-3-ylmethyl)amino]-1H-pyrazole-5-carboxylic acid Openeye Name: 3-[3-furylmethyl(3-thienylmethyl)amino]-1H-pyrazole-5-carboxylic acid CAS Name: 3-[3-furanylmethyl(3-thiophenylmethyl)amino]-1H-pyrazole-5-carboxylic acid IUPAC Name: 3-[furan-3-ylmethyl(thiophen-3-ylmethyl)amino]-1H-pyrazole-5-carboxylic acid Traditional Name: 3-[3-furfuryl(3-thenyl)amino]-1H-pyrazole-5-carboxylic acid Formula: C14H13N3O3S MolecularWeight: 303.33632

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC=C1CN(CC2=CSC=C2)C3=NNC(=C3)C(=O)O

Isomeric SMILES

C1=COC=C1CN(CC2=CSC=C2)C3=NNC(=C3)C(=O)O

InChI

InChI=1S/C14H13N3O3S/c18-14(19)12-5-13(16-15-12)17(6-10-1-3-20-8-10)7-11-2-4-21-9-11/h1-5,8-9H,6-7H2,(H,15,16)(H,18,19)