(Z)-3-[[2-(furan-2-ylmethyl)pyrazol-3-yl]amino]-2-thiophen-2-ylcarbonyl-prop-2-enoic acid

Systemtic Name: (Z)-3-[[2-(furan-2-ylmethyl)pyrazol-3-yl]amino]-2-thiophen-2-ylcarbonyl-prop-2-enoic acid Openeye Name: (Z)-3-[[2-(2-furylmethyl)pyrazol-3-yl]amino]-2-(thiophene-2-carbonyl)prop-2-enoic acid CAS Name: (Z)-3-[[2-(2-furanylmethyl)-3-pyrazolyl]amino]-2-[oxo(thiophen-2-yl)methyl]-2-propenoic acid IUPAC Name: (Z)-3-[[2-(furan-2-ylmethyl)pyrazol-3-yl]amino]-2-(thiophene-2-carbonyl)prop-2-enoic acid Traditional Name: (Z)-3-[[2-(2-furfuryl)pyrazol-3-yl]amino]-2-(2-thenoyl)acrylic acid Formula: C16H13N3O4S MolecularWeight: 343.35712

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CN2C(=CC=N2)NC=C(C(=O)C3=CC=CS3)C(=O)O

Isomeric SMILES

C1=COC(=C1)CN2C(=CC=N2)N/C=C(/C(=O)C3=CC=CS3)\C(=O)O

InChI

InChI=1S/C16H13N3O4S/c20-15(13-4-2-8-24-13)12(16(21)22)9-17-14-5-6-18-19(14)10-11-3-1-7-23-11/h1-9,17H,10H2,(H,21,22)/b12-9-