2-bromanyl-N'-[3-(5,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)propanoyl]benzohydrazide

Systemtic Name: 2-bromanyl-N'-[3-(5,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)propanoyl]benzohydrazide Openeye Name: 2-bromo-N'-[3-(5,6-dimethyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl)propanoyl]benzohydrazide CAS Name: 2-bromo-N'-[3-(5,6-dimethyl-4-oxo-3-thieno[2,3-d]pyrimidinyl)-1-oxopropyl]benzohydrazide IUPAC Name: 2-bromo-N'-[3-(5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)propanoyl]benzohydrazide Traditional Name: 2-bromo-N'-[3-(4-keto-5,6-dimethyl-thieno[2,3-d]pyrimidin-3-yl)propanoyl]benzohydrazide Formula: C18H17BrN4O3S MolecularWeight: 449.32158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)CCC(=O)NNC(=O)C3=CC=CC=C3Br)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)CCC(=O)NNC(=O)C3=CC=CC=C3Br)C

InChI

InChI=1S/C18H17BrN4O3S/c1-10-11(2)27-17-15(10)18(26)23(9-20-17)8-7-14(24)21-22-16(25)12-5-3-4-6-13(12)19/h3-6,9H,7-8H2,1-2H3,(H,21,24)(H,22,25)