AC1LQC4X

1-(3-nitrophenyl)-2-[(4-prop-2-enyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone

Also Known As: SR-01000245369-1|1-(3-nitrophenyl)-2-[(4-prop-2-enyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone|1-(3-nitrophenyl)-2-(4-prop-2-enyl-5-(3-pyridyl)(1,2,4-triazol-3-ylthio))ethan -1-one|2-((4-allyl-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl)thio)-1-(3-nitrophenyl)ethanone|1-(3-nitrophenyl)-2-{[4-(prop-2-en-1-yl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone

Molecular Formula	C18H15N5O3S
Molecular Weight	381.08957 g/mol
LogP	3.4093
Topological Polar Surface Area	103.81 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	7
Rotatable Bonds	8
Exact Mass	381.08957
Monoisotopic Mass	381.08957
Heavy Atoms	27
Complexity	987.672

Chemical Identifiers

CAS Number	433249-79-7
SMILES	C=CCN1C(=NN=C1SCC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C3=CN=CC=C3