methyl 2-[[(E)-3-(5-phenylfuran-2-yl)prop-2-enoyl]amino]-1,3-benzothiazole-6-carboxylate

Systemtic Name: methyl 2-[[(E)-3-(5-phenylfuran-2-yl)prop-2-enoyl]amino]-1,3-benzothiazole-6-carboxylate Openeye Name: methyl 2-[[(E)-3-(5-phenyl-2-furyl)prop-2-enoyl]amino]-1,3-benzothiazole-6-carboxylate CAS Name: 2-[[(E)-1-oxo-3-(5-phenyl-2-furanyl)prop-2-enyl]amino]-1,3-benzothiazole-6-carboxylic acid methyl ester IUPAC Name: methyl 2-[[(E)-3-(5-phenylfuran-2-yl)prop-2-enoyl]amino]-1,3-benzothiazole-6-carboxylate Traditional Name: 2-[[(E)-3-(5-phenyl-2-furyl)acryloyl]amino]-1,3-benzothiazole-6-carboxylic acid methyl ester Formula: C22H16N2O4S MolecularWeight: 404.43844

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C=CC3=CC=C(O3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)/C=C/C3=CC=C(O3)C4=CC=CC=C4

InChI

InChI=1S/C22H16N2O4S/c1-27-21(26)15-7-10-17-19(13-15)29-22(23-17)24-20(25)12-9-16-8-11-18(28-16)14-5-3-2-4-6-14/h2-13H,1H3,(H,23,24,25)/b12-9+