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

Systemtic Name: methyl 2-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]-1,3-benzothiazole-6-carboxylate Openeye Name: methyl 2-[[(E)-3-(2-furyl)prop-2-enoyl]amino]-1,3-benzothiazole-6-carboxylate CAS Name: 2-[[(E)-3-(2-furanyl)-1-oxoprop-2-enyl]amino]-1,3-benzothiazole-6-carboxylic acid methyl ester IUPAC Name: methyl 2-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]-1,3-benzothiazole-6-carboxylate Traditional Name: 2-[[(E)-3-(2-furyl)acryloyl]amino]-1,3-benzothiazole-6-carboxylic acid methyl ester Formula: C16H12N2O4S MolecularWeight: 328.34248

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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=CO3

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)/C=C/C3=CC=CO3

InChI

InChI=1S/C16H12N2O4S/c1-21-15(20)10-4-6-12-13(9-10)23-16(17-12)18-14(19)7-5-11-3-2-8-22-11/h2-9H,1H3,(H,17,18,19)/b7-5+