methyl 5-[(E)-3-(1,3-benzothiazol-2-ylamino)-3-oxidanylidene-prop-1-enyl]-2-methyl-furan-3-carboxylate

Systemtic Name: methyl 5-[(E)-3-(1,3-benzothiazol-2-ylamino)-3-oxidanylidene-prop-1-enyl]-2-methyl-furan-3-carboxylate Openeye Name: methyl 5-[(E)-3-(1,3-benzothiazol-2-ylamino)-3-oxo-prop-1-enyl]-2-methyl-furan-3-carboxylate CAS Name: 5-[(E)-3-(1,3-benzothiazol-2-ylamino)-3-oxoprop-1-enyl]-2-methyl-3-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[(E)-3-(1,3-benzothiazol-2-ylamino)-3-oxoprop-1-enyl]-2-methylfuran-3-carboxylate Traditional Name: 5-[(E)-3-(1,3-benzothiazol-2-ylamino)-3-keto-prop-1-enyl]-2-methyl-furan-3-carboxylic acid methyl ester Formula: C17H14N2O4S MolecularWeight: 342.36906

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)C=CC(=O)NC2=NC3=CC=CC=C3S2)C(=O)OC

Isomeric SMILES

CC1=C(C=C(O1)/C=C/C(=O)NC2=NC3=CC=CC=C3S2)C(=O)OC

InChI

InChI=1S/C17H14N2O4S/c1-10-12(16(21)22-2)9-11(23-10)7-8-15(20)19-17-18-13-5-3-4-6-14(13)24-17/h3-9H,1-2H3,(H,18,19,20)/b8-7+