N-[5-[(4-bromanyl-3-chloranyl-phenyl)methyl]-4-methyl-1,3-thiazol-2-yl]-3-methyl-1-oxidanylidene-4H-isochromene-3-carboxamide

Systemtic Name: N-[5-[(4-bromanyl-3-chloranyl-phenyl)methyl]-4-methyl-1,3-thiazol-2-yl]-3-methyl-1-oxidanylidene-4H-isochromene-3-carboxamide Openeye Name: N-[5-[(4-bromo-3-chloro-phenyl)methyl]-4-methyl-thiazol-2-yl]-3-methyl-1-oxo-isochromane-3-carboxamide CAS Name: N-[5-[(4-bromo-3-chlorophenyl)methyl]-4-methyl-2-thiazolyl]-3-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: N-[5-[(4-bromo-3-chlorophenyl)methyl]-4-methyl-1,3-thiazol-2-yl]-3-methyl-1-oxo-4H-isochromene-3-carboxamide Traditional Name: N-[5-(4-bromo-3-chloro-benzyl)-4-methyl-thiazol-2-yl]-1-keto-3-methyl-isochroman-3-carboxamide Formula: C22H18BrClN2O3S MolecularWeight: 505.81192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)C2(CC3=CC=CC=C3C(=O)O2)C)CC4=CC(=C(C=C4)Br)Cl

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)C2(CC3=CC=CC=C3C(=O)O2)C)CC4=CC(=C(C=C4)Br)Cl

InChI

InChI=1S/C22H18BrClN2O3S/c1-12-18(10-13-7-8-16(23)17(24)9-13)30-21(25-12)26-20(28)22(2)11-14-5-3-4-6-15(14)19(27)29-22/h3-9H,10-11H2,1-2H3,(H,25,26,28)