3-(5-bromanyl-2-methoxy-phenyl)-N-[[2-(3-bromanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-3H-1,3-benzoxazol-5-yl]carbamothioyl]prop-2-enamide

Systemtic Name: 3-(5-bromanyl-2-methoxy-phenyl)-N-[[2-(3-bromanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-3H-1,3-benzoxazol-5-yl]carbamothioyl]prop-2-enamide Openeye Name: 3-(5-bromo-2-methoxy-phenyl)-N-[[2-(3-bromo-4-oxo-cyclohexa-2,5-dien-1-ylidene)-3H-1,3-benzoxazol-5-yl]carbamothioyl]prop-2-enamide CAS Name: 3-(5-bromo-2-methoxyphenyl)-N-[[[2-(3-bromo-4-oxo-1-cyclohexa-2,5-dienylidene)-3H-1,3-benzoxazol-5-yl]amino]-sulfanylidenemethyl]-2-propenamide IUPAC Name: 3-(5-bromo-2-methoxyphenyl)-N-[[2-(3-bromo-4-oxocyclohexa-2,5-dien-1-ylidene)-3H-1,3-benzoxazol-5-yl]carbamothioyl]prop-2-enamide Traditional Name: N-[[2-(3-bromo-4-keto-cyclohexa-2,5-dien-1-ylidene)-3H-1,3-benzoxazol-5-yl]thiocarbamoyl]-3-(5-bromo-2-methoxy-phenyl)acrylamide Formula: C24H17Br2N3O4S MolecularWeight: 603.28248

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C=CC(=O)NC(=S)NC2=CC3=C(C=C2)OC(=C4C=CC(=O)C(=C4)Br)N3

Isomeric SMILES

COC1=C(C=C(C=C1)Br)C=CC(=O)NC(=S)NC2=CC3=C(C=C2)OC(=C4C=CC(=O)C(=C4)Br)N3

InChI

InChI=1S/C24H17Br2N3O4S/c1-32-20-7-4-15(25)10-13(20)3-9-22(31)29-24(34)27-16-5-8-21-18(12-16)28-23(33-21)14-2-6-19(30)17(26)11-14/h2-12,28H,1H3,(H2,27,29,31,34)