5-[[5-[3-(2,5-dimethylpyrrol-1-yl)thiophen-2-yl]-1H-pyrazol-3-yl]amino]-5-oxidanyl-hexan-3-one

Systemtic Name: 5-[[5-[3-(2,5-dimethylpyrrol-1-yl)thiophen-2-yl]-1H-pyrazol-3-yl]amino]-5-oxidanyl-hexan-3-one Openeye Name: 5-[[5-[3-(2,5-dimethylpyrrol-1-yl)-2-thienyl]-1H-pyrazol-3-yl]amino]-5-hydroxy-hexan-3-one CAS Name: 5-[[5-[3-(2,5-dimethyl-1-pyrrolyl)-2-thiophenyl]-1H-pyrazol-3-yl]amino]-5-hydroxy-3-hexanone IUPAC Name: 5-[[5-[3-(2,5-dimethylpyrrol-1-yl)thiophen-2-yl]-1H-pyrazol-3-yl]amino]-5-hydroxyhexan-3-one Traditional Name: 5-[[5-[3-(2,5-dimethylpyrrol-1-yl)-2-thienyl]-1H-pyrazol-3-yl]amino]-5-hydroxy-hexan-3-one Formula: C19H24N4O2S MolecularWeight: 372.48446

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)CC(C)(NC1=NNC(=C1)C2=C(C=CS2)N3C(=CC=C3C)C)O

Isomeric SMILES

CCC(=O)CC(C)(NC1=NNC(=C1)C2=C(C=CS2)N3C(=CC=C3C)C)O

InChI

InChI=1S/C19H24N4O2S/c1-5-14(24)11-19(4,25)20-17-10-15(21-22-17)18-16(8-9-26-18)23-12(2)6-7-13(23)3/h6-10,25H,5,11H2,1-4H3,(H2,20,21,22)