5-[[(4,6-dimethylpyrimidin-2-yl)amino]carbamoyl]-2-methyl-N-(phenylmethyl)benzenesulfonamide

Systemtic Name: 5-[[(4,6-dimethylpyrimidin-2-yl)amino]carbamoyl]-2-methyl-N-(phenylmethyl)benzenesulfonamide Openeye Name: N-benzyl-5-[[(4,6-dimethylpyrimidin-2-yl)amino]carbamoyl]-2-methyl-benzenesulfonamide CAS Name: 5-[[(4,6-dimethyl-2-pyrimidinyl)hydrazo]-oxomethyl]-2-methyl-N-(phenylmethyl)benzenesulfonamide IUPAC Name: N-benzyl-5-[[(4,6-dimethylpyrimidin-2-yl)amino]carbamoyl]-2-methylbenzenesulfonamide Traditional Name: N-benzyl-5-[[(4,6-dimethylpyrimidin-2-yl)amino]carbamoyl]-2-methyl-benzenesulfonamide Formula: C21H23N5O3S MolecularWeight: 425.50402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NNC2=NC(=CC(=N2)C)C)S(=O)(=O)NCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NNC2=NC(=CC(=N2)C)C)S(=O)(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C21H23N5O3S/c1-14-9-10-18(20(27)25-26-21-23-15(2)11-16(3)24-21)12-19(14)30(28,29)22-13-17-7-5-4-6-8-17/h4-12,22H,13H2,1-3H3,(H,25,27)(H,23,24,26)