N'-[4-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]phenyl]carbonyl-3-pyrrolidin-1-ylsulfonyl-benzohydrazide

Systemtic Name: N'-[4-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]phenyl]carbonyl-3-pyrrolidin-1-ylsulfonyl-benzohydrazide Openeye Name: N'-[4-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]benzoyl]-3-pyrrolidin-1-ylsulfonyl-benzohydrazide CAS Name: N'-[[4-[[(4,6-dimethyl-2-pyrimidinyl)thio]methyl]phenyl]-oxomethyl]-3-(1-pyrrolidinylsulfonyl)benzohydrazide IUPAC Name: N'-[4-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]benzoyl]-3-pyrrolidin-1-ylsulfonylbenzohydrazide Traditional Name: N'-[4-[[(4,6-dimethylpyrimidin-2-yl)thio]methyl]benzoyl]-3-pyrrolidinosulfonyl-benzohydrazide Formula: C25H27N5O4S2 MolecularWeight: 525.64298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC2=CC=C(C=C2)C(=O)NNC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCCC4)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC2=CC=C(C=C2)C(=O)NNC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCCC4)C

InChI

InChI=1S/C25H27N5O4S2/c1-17-14-18(2)27-25(26-17)35-16-19-8-10-20(11-9-19)23(31)28-29-24(32)21-6-5-7-22(15-21)36(33,34)30-12-3-4-13-30/h5-11,14-15H,3-4,12-13,16H2,1-2H3,(H,28,31)(H,29,32)