2-[2-[(2-acetamido-4-oxidanylidene-1,3-thiazol-5-ylidene)methyl]-4-bromanyl-phenoxy]-N-(3-methylphenyl)ethanamide

Systemtic Name: 2-[2-[(2-acetamido-4-oxidanylidene-1,3-thiazol-5-ylidene)methyl]-4-bromanyl-phenoxy]-N-(3-methylphenyl)ethanamide Openeye Name: 2-[2-[(2-acetamido-4-oxo-thiazol-5-ylidene)methyl]-4-bromo-phenoxy]-N-(m-tolyl)acetamide CAS Name: 2-[2-[(2-acetamido-4-oxo-5-thiazolylidene)methyl]-4-bromophenoxy]-N-(3-methylphenyl)acetamide IUPAC Name: 2-[2-[(2-acetamido-4-oxo-1,3-thiazol-5-ylidene)methyl]-4-bromophenoxy]-N-(3-methylphenyl)acetamide Traditional Name: 2-[2-[(2-acetamido-4-keto-2-thiazolin-5-ylidene)methyl]-4-bromo-phenoxy]-N-(m-tolyl)acetamide Formula: C21H18BrN3O4S MolecularWeight: 488.35432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)COC2=C(C=C(C=C2)Br)C=C3C(=O)N=C(S3)NC(=O)C

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)COC2=C(C=C(C=C2)Br)C=C3C(=O)N=C(S3)NC(=O)C

InChI

InChI=1S/C21H18BrN3O4S/c1-12-4-3-5-16(8-12)24-19(27)11-29-17-7-6-15(22)9-14(17)10-18-20(28)25-21(30-18)23-13(2)26/h3-10H,11H2,1-2H3,(H,24,27)(H,23,25,26,28)