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2-[4-(6-hexyl-7-oxidanyl-2-oxidanylidene-chromen-3-yl)-1,3-thiazol-2-yl]ethanenitrile

2-[4-(6-hexyl-7-oxidanyl-2-oxidanylidene-chromen-3-yl)-1,3-thiazol-2-yl]ethanenitrile

Systemtic Name:2-[4-(6-hexyl-7-oxidanyl-2-oxidanylidene-chromen-3-yl)-1,3-thiazol-2-yl]ethanenitrile
Openeye Name:2-[4-(6-hexyl-7-hydroxy-2-oxo-chromen-3-yl)thiazol-2-yl]acetonitrile
CAS Name:2-[4-(6-hexyl-7-hydroxy-2-oxo-1-benzopyran-3-yl)-2-thiazolyl]acetonitrile
IUPAC Name:2-[4-(6-hexyl-7-hydroxy-2-oxochromen-3-yl)-1,3-thiazol-2-yl]acetonitrile
Traditional Name:2-[4-(6-hexyl-7-hydroxy-2-keto-chromen-3-yl)thiazol-2-yl]acetonitrile
Formula: C20H20N2O3S
MolecularWeight: 368.4494
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C=C2C(=C1)C=C(C(=O)O2)C3=CSC(=N3)CC#N)O


Isomeric SMILES

CCCCCCC1=C(C=C2C(=C1)C=C(C(=O)O2)C3=CSC(=N3)CC#N)O


InChI

InChI=1S/C20H20N2O3S/c1-2-3-4-5-6-13-9-14-10-15(16-12-26-19(22-16)7-8-21)20(24)25-18(14)11-17(13)23/h9-12,23H,2-7H2,1H3


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