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

Systemtic Name: 3-azanyl-N-[3-chloranyl-4-[(3-methylsulfonylphenyl)carbonylamino]phenyl]pyrazine-2-carboxamide Openeye Name: 3-amino-N-[3-chloro-4-[(3-methylsulfonylbenzoyl)amino]phenyl]pyrazine-2-carboxamide CAS Name: 3-amino-N-[3-chloro-4-[[(3-methylsulfonylphenyl)-oxomethyl]amino]phenyl]-2-pyrazinecarboxamide IUPAC Name: 3-amino-N-[3-chloro-4-[(3-methylsulfonylbenzoyl)amino]phenyl]pyrazine-2-carboxamide Traditional Name: 3-amino-N-[3-chloro-4-[(3-mesylbenzoyl)amino]phenyl]pyrazinamide Formula: C19H16ClN5O4S MolecularWeight: 445.87944

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1)C(=O)NC2=C(C=C(C=C2)NC(=O)C3=NC=CN=C3N)Cl

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1)C(=O)NC2=C(C=C(C=C2)NC(=O)C3=NC=CN=C3N)Cl

InChI

InChI=1S/C19H16ClN5O4S/c1-30(28,29)13-4-2-3-11(9-13)18(26)25-15-6-5-12(10-14(15)20)24-19(27)16-17(21)23-8-7-22-16/h2-10H,1H3,(H2,21,23)(H,24,27)(H,25,26)