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4-[(1-methyl-5-nitroimidazol-2-yl)methylsulfanyl]benzonitrile

4-[(1-methyl-5-nitroimidazol-2-yl)methylsulfanyl]benzonitrile structure

CAS No:
61717-41-7
Formula:
C12H10N4O2S
Chemical Name:
4-[(1-methyl-5-nitroimidazol-2-yl)methylsulfanyl]benzonitrile
Synonyms:
61717-41-7;NSC350381;4-(1-Methyl-5-nitro-1H-imidazol-2-ylmethylsulfanyl)-benzonitrile;NSC 350381;DTXSID40210722;ZINC13211675;NSC-350381;4-[(1-methyl-5-nitro-imidazol-2-yl)methylsulfanyl]benzonitrile;4-(((1-Methyl-5-nitro-1H-imidazol-2-yl)methyl)thio)benzonitrile

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4-[(1-methyl-5-nitroimidazol-2-yl)methylsulfanyl]benzonitrile Basic Attributes

Molecular Weight：

274.30 g/mol

Exact Mass：

274.05244675 g/mol

NSC Number：

350381

DSSTox ID：

DTXSID40210722

Characteristics

PSA：

113 Å²

Computed Properties

Molecular Weight:274.30
XLogP3:2.2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:274.05244675
Monoisotopic Mass:274.05244675
Topological Polar Surface Area:113
Heavy Atom Count:19
Complexity:370
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-[(1-methyl-5-nitroimidazol-2-yl)methylsulfanyl]benzonitrile

Basic Attributes
Characteristics
Computed Properties

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