N'-[3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)propanoyl]-2-pyrrol-1-yl-benzohydrazide

Systemtic Name: N'-[3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)propanoyl]-2-pyrrol-1-yl-benzohydrazide Openeye Name: N'-[3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)propanoyl]-2-pyrrol-1-yl-benzohydrazide CAS Name: N'-[3-[4,6-dimethyl-2-(methylthio)-5-pyrimidinyl]-1-oxopropyl]-2-(1-pyrrolyl)benzohydrazide IUPAC Name: N'-[3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)propanoyl]-2-pyrrol-1-ylbenzohydrazide Traditional Name: N'-[3-[4,6-dimethyl-2-(methylthio)pyrimidin-5-yl]propanoyl]-2-pyrrol-1-yl-benzohydrazide Formula: C21H23N5O2S MolecularWeight: 409.50462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)SC)C)CCC(=O)NNC(=O)C2=CC=CC=C2N3C=CC=C3

Isomeric SMILES

CC1=C(C(=NC(=N1)SC)C)CCC(=O)NNC(=O)C2=CC=CC=C2N3C=CC=C3

InChI

InChI=1S/C21H23N5O2S/c1-14-16(15(2)23-21(22-14)29-3)10-11-19(27)24-25-20(28)17-8-4-5-9-18(17)26-12-6-7-13-26/h4-9,12-13H,10-11H2,1-3H3,(H,24,27)(H,25,28)