[2-(3-cyanoanilino)-2-oxoethyl] 2-(2-cyanophenyl)sulfanylbenzoate
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[2-(3-cyanoanilino)-2-oxoethyl] 2-(2-cyanophenyl)sulfanylbenzoate
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CAS No:
380180-06-3
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Formula:
C23H15N3O3S
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Chemical Name:
[2-(3-cyanoanilino)-2-oxoethyl] 2-(2-cyanophenyl)sulfanylbenzoate
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Synonyms:
Oprea1_846439;MLS000390735;CHEMBL1530657;HMS2561L14;ZINC3235691;AKOS002488782;MCULE-4757621280;NCGC00318082-01;SMR000259773;AB00545565-06;Z18834500;[(3-cyanophenyl)carbamoyl]methyl 2-[(2-cyanophenyl)sulfanyl]benzoate;380180-06-3
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CAS No:
[2-(3-cyanoanilino)-2-oxoethyl] 2-(2-cyanophenyl)sulfanylbenzoate Basic Attributes
413.4 g/mol
413.08341252 g/mol
Computed Properties
Molecular Weight:413.4
XLogP3:4.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:7
Exact Mass:413.08341252
Monoisotopic Mass:413.08341252
Topological Polar Surface Area:128
Heavy Atom Count:30
Complexity:709
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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