N-[3-chloranyl-4-[(3-methylsulfonylphenyl)carbonylamino]phenyl]-5-methyl-pyrazine-2-carboxamide

Systemtic Name: N-[3-chloranyl-4-[(3-methylsulfonylphenyl)carbonylamino]phenyl]-5-methyl-pyrazine-2-carboxamide Openeye Name: N-[3-chloro-4-[(3-methylsulfonylbenzoyl)amino]phenyl]-5-methyl-pyrazine-2-carboxamide CAS Name: N-[3-chloro-4-[[(3-methylsulfonylphenyl)-oxomethyl]amino]phenyl]-5-methyl-2-pyrazinecarboxamide IUPAC Name: N-[3-chloro-4-[(3-methylsulfonylbenzoyl)amino]phenyl]-5-methylpyrazine-2-carboxamide Traditional Name: N-[3-chloro-4-[(3-mesylbenzoyl)amino]phenyl]-5-methyl-pyrazinamide Formula: C20H17ClN4O4S MolecularWeight: 444.89138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N=C1)C(=O)NC2=CC(=C(C=C2)NC(=O)C3=CC(=CC=C3)S(=O)(=O)C)Cl

Isomeric SMILES

CC1=NC=C(N=C1)C(=O)NC2=CC(=C(C=C2)NC(=O)C3=CC(=CC=C3)S(=O)(=O)C)Cl

InChI

InChI=1S/C20H17ClN4O4S/c1-12-10-23-18(11-22-12)20(27)24-14-6-7-17(16(21)9-14)25-19(26)13-4-3-5-15(8-13)30(2,28)29/h3-11H,1-2H3,(H,24,27)(H,25,26)