2-{[5-(4-aminophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-1-{4-nitrophenyl}ethanone
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2-{[5-(4-aminophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-1-{4-nitrophenyl}ethanone
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CAS No:
354125-75-0
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Formula:
C17H15N5O3S
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Chemical Name:
2-{[5-(4-aminophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-1-{4-nitrophenyl}ethanone
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Synonyms:
2-{[5-(4-aminophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-1-{4-nitrophenyl}ethanone;2-{[5-(4-aminophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(4-nitrophenyl)ethanone;Cambridge id 6875133;SCHEMBL4216773;ZINC694142;STL357621;AKOS003250911;MCULE-4994678948;2-[[5-(4-aminophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-1-(4-nitrophenyl)ethanone;AB00122333-01
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CAS No:
2-{[5-(4-aminophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-1-{4-nitrophenyl}ethanone Basic Attributes
369.3977
369.09
Computed Properties
Molecular Weight:369.4
XLogP3:2.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:5
Exact Mass:369.08956053
Monoisotopic Mass:369.08956053
Topological Polar Surface Area:145
Heavy Atom Count:26
Complexity:501
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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