N-[(2S)-1-(3-cyanoanilino)-3-methyl-1-oxobutan-2-yl]-3-methylbenzamide
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![N-[(2S)-1-(3-cyanoanilino)-3-methyl-1-oxobutan-2-yl]-3-methylbenzamide structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/9dfdb5a0f18043d4b5245c1a323c0dd1.png "N-[(2S)-1-(3-cyanoanilino)-3-methyl-1-oxobutan-2-yl]-3-methylbenzamide")
N-[(2S)-1-(3-cyanoanilino)-3-methyl-1-oxobutan-2-yl]-3-methylbenzamide
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CAS No:
956193-96-7
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Formula:
C20H21N3O2
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Chemical Name:
N-[(2S)-1-(3-cyanoanilino)-3-methyl-1-oxobutan-2-yl]-3-methylbenzamide
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Synonyms:
ZINC2664203;AKOS034827182;MCULE-9002870751;Z56997747;(2S)-N-(3-cyanophenyl)-3-methyl-2-[(3-methylphenyl)formamido]butanamide;956193-96-7
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CAS No:
N-[(2S)-1-(3-cyanoanilino)-3-methyl-1-oxobutan-2-yl]-3-methylbenzamide Basic Attributes
335.4 g/mol
335.16337692 g/mol
Computed Properties
Molecular Weight:335.4
XLogP3:3.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:335.16337692
Monoisotopic Mass:335.16337692
Topological Polar Surface Area:82
Heavy Atom Count:25
Complexity:522
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Guide of N-[(2S)-1-(3-cyanoanilino)-3-methyl-1-oxobutan-2-yl]-3-methylbenzamide
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