3-(1,3-benzothiazol-2-yl)-N-(4-ethylsulfonylphenyl)pyrazine-2-carboxamide

Systemtic Name: 3-(1,3-benzothiazol-2-yl)-N-(4-ethylsulfonylphenyl)pyrazine-2-carboxamide Openeye Name: 3-(1,3-benzothiazol-2-yl)-N-(4-ethylsulfonylphenyl)pyrazine-2-carboxamide CAS Name: 3-(1,3-benzothiazol-2-yl)-N-(4-ethylsulfonylphenyl)-2-pyrazinecarboxamide IUPAC Name: 3-(1,3-benzothiazol-2-yl)-N-(4-ethylsulfonylphenyl)pyrazine-2-carboxamide Traditional Name: 3-(1,3-benzothiazol-2-yl)-N-(4-esylphenyl)pyrazinamide Formula: C20H16N4O3S2 MolecularWeight: 424.49604

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC=C(C=C1)NC(=O)C2=NC=CN=C2C3=NC4=CC=CC=C4S3

Isomeric SMILES

CCS(=O)(=O)C1=CC=C(C=C1)NC(=O)C2=NC=CN=C2C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H16N4O3S2/c1-2-29(26,27)14-9-7-13(8-10-14)23-19(25)17-18(22-12-11-21-17)20-24-15-5-3-4-6-16(15)28-20/h3-12H,2H2,1H3,(H,23,25)