N-[[6-cyano-5-(4-methylphenyl)sulfonyl-pyrazin-2-yl]carbamoyl]-2,6-dimethyl-benzamide

Systemtic Name: N-[[6-cyano-5-(4-methylphenyl)sulfonyl-pyrazin-2-yl]carbamoyl]-2,6-dimethyl-benzamide Openeye Name: N-[[6-cyano-5-(p-tolylsulfonyl)pyrazin-2-yl]carbamoyl]-2,6-dimethyl-benzamide CAS Name: N-[[[6-cyano-5-(4-methylphenyl)sulfonyl-2-pyrazinyl]amino]-oxomethyl]-2,6-dimethylbenzamide IUPAC Name: N-[[6-cyano-5-(4-methylphenyl)sulfonylpyrazin-2-yl]carbamoyl]-2,6-dimethylbenzamide Traditional Name: N-[(6-cyano-5-tosyl-pyrazin-2-yl)carbamoyl]-2,6-dimethyl-benzamide Formula: C22H19N5O4S MolecularWeight: 449.48236

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=NC=C(N=C2C#N)NC(=O)NC(=O)C3=C(C=CC=C3C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=NC=C(N=C2C#N)NC(=O)NC(=O)C3=C(C=CC=C3C)C

InChI

InChI=1S/C22H19N5O4S/c1-13-7-9-16(10-8-13)32(30,31)21-17(11-23)25-18(12-24-21)26-22(29)27-20(28)19-14(2)5-4-6-15(19)3/h4-10,12H,1-3H3,(H2,25,26,27,28,29)