N-[5-[(4-bromanyl-3-chloranyl-phenyl)methyl]-4-methyl-1,3-thiazol-2-yl]-1-oxidanylidene-3-phenyl-3,4-dihydroisochromene-6-carboxamide

Systemtic Name: N-[5-[(4-bromanyl-3-chloranyl-phenyl)methyl]-4-methyl-1,3-thiazol-2-yl]-1-oxidanylidene-3-phenyl-3,4-dihydroisochromene-6-carboxamide Openeye Name: N-[5-[(4-bromo-3-chloro-phenyl)methyl]-4-methyl-thiazol-2-yl]-1-oxo-3-phenyl-isochromane-6-carboxamide CAS Name: N-[5-[(4-bromo-3-chlorophenyl)methyl]-4-methyl-2-thiazolyl]-1-oxo-3-phenyl-3,4-dihydro-1H-2-benzopyran-6-carboxamide IUPAC Name: N-[5-[(4-bromo-3-chlorophenyl)methyl]-4-methyl-1,3-thiazol-2-yl]-1-oxo-3-phenyl-3,4-dihydroisochromene-6-carboxamide Traditional Name: N-[5-(4-bromo-3-chloro-benzyl)-4-methyl-thiazol-2-yl]-1-keto-3-phenyl-isochroman-6-carboxamide Formula: C27H20BrClN2O3S MolecularWeight: 567.8813

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)C2=CC3=C(C=C2)C(=O)OC(C3)C4=CC=CC=C4)CC5=CC(=C(C=C5)Br)Cl

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)C2=CC3=C(C=C2)C(=O)OC(C3)C4=CC=CC=C4)CC5=CC(=C(C=C5)Br)Cl

InChI

InChI=1S/C27H20BrClN2O3S/c1-15-24(12-16-7-10-21(28)22(29)11-16)35-27(30-15)31-25(32)18-8-9-20-19(13-18)14-23(34-26(20)33)17-5-3-2-4-6-17/h2-11,13,23H,12,14H2,1H3,(H,30,31,32)