2-[2-[[3-(naphthalen-1-ylmethyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]iminomethyl]phenoxy]acetic acid
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![2-[2-[[3-(naphthalen-1-ylmethyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]iminomethyl]phenoxy]acetic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/3df74fb83488440391b449a9973457ef.png "2-[2-[[3-(naphthalen-1-ylmethyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]iminomethyl]phenoxy]acetic acid")
2-[2-[[3-(naphthalen-1-ylmethyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]iminomethyl]phenoxy]acetic acid
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CAS No:
744213-52-3
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Formula:
C22H18N4O3S
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Chemical Name:
2-[2-[[3-(naphthalen-1-ylmethyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]iminomethyl]phenoxy]acetic acid
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Synonyms:
AKOS034409812;MCULE-8936864255;Z49670629;2-{2-[({3-[(naphthalen-1-yl)methyl]-5-sulfanyl-4H-1,2,4-triazol-4-yl}imino)methyl]phenoxy}acetic acid;744213-52-3
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CAS No:
2-[2-[[3-(naphthalen-1-ylmethyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]iminomethyl]phenoxy]acetic acid Basic Attributes
418.5 g/mol
418.10996162 g/mol
Computed Properties
Molecular Weight:418.5
XLogP3:4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:7
Exact Mass:418.10996162
Monoisotopic Mass:418.10996162
Topological Polar Surface Area:119
Heavy Atom Count:30
Complexity:698
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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