ethyl (E,1Z)-3-bromanyl-N-(4-methylphenyl)sulfonyl-4-oxidanylidene-4-phenyl-2-(phenylmethyl)but-2-enimidate

Systemtic Name: ethyl (E,1Z)-3-bromanyl-N-(4-methylphenyl)sulfonyl-4-oxidanylidene-4-phenyl-2-(phenylmethyl)but-2-enimidate Openeye Name: ethyl (E,1Z)-2-benzyl-3-bromo-4-oxo-4-phenyl-N-(p-tolylsulfonyl)but-2-enimidate CAS Name: (E,1Z)-3-bromo-N-(4-methylphenyl)sulfonyl-4-oxo-4-phenyl-2-(phenylmethyl)-2-butenimidic acid ethyl ester IUPAC Name: ethyl (E,1Z)-2-benzyl-3-bromo-N-(4-methylphenyl)sulfonyl-4-oxo-4-phenylbut-2-enimidate Traditional Name: (E,1Z)-2-benzyl-3-bromo-4-keto-4-phenyl-N-tosyl-but-2-enimidic acid ethyl ester Formula: C26H24BrNO4S MolecularWeight: 526.44206

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=NS(=O)(=O)C1=CC=C(C=C1)C)C(=C(C(=O)C2=CC=CC=C2)Br)CC3=CC=CC=C3

Isomeric SMILES

CCO/C(=N\S(=O)(=O)C1=CC=C(C=C1)C)/C(=C(\C(=O)C2=CC=CC=C2)/Br)/CC3=CC=CC=C3

InChI

InChI=1S/C26H24BrNO4S/c1-3-32-26(28-33(30,31)22-16-14-19(2)15-17-22)23(18-20-10-6-4-7-11-20)24(27)25(29)21-12-8-5-9-13-21/h4-17H,3,18H2,1-2H3/b24-23+,28-26-