N-(2,3-dimethylphenyl)-2-[[4-prop-2-enyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
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N-(2,3-dimethylphenyl)-2-[[4-prop-2-enyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
structure -
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CAS No:
896845-86-6
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Formula:
C20H22N4OS2
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Chemical Name:
N-(2,3-dimethylphenyl)-2-[[4-prop-2-enyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
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Synonyms:
ZINC2231067;STK697280;AKOS003908670;MCULE-9976622566;N-(2,3-dimethylphenyl)-2-{[4-(prop-2-en-1-yl)-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide;ST50425180;896845-86-6;N-(2,3-dimethylphenyl)-2-[4-prop-2-enyl-5-(2-thienylmethyl)(1,2,4-triazol-3-yl thio)]acetamide
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CAS No:
N-(2,3-dimethylphenyl)-2-[[4-prop-2-enyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide Basic Attributes
398.5 g/mol
398.12350369 g/mol
Computed Properties
Molecular Weight:398.5
XLogP3:4.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:8
Exact Mass:398.12350369
Monoisotopic Mass:398.12350369
Topological Polar Surface Area:113
Heavy Atom Count:27
Complexity:506
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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