N-[(3-phenoxyphenyl)carbamothioyl]pyrazine-2-carboxamide

Systemtic Name: N-[(3-phenoxyphenyl)carbamothioyl]pyrazine-2-carboxamide Openeye Name: N-[(3-phenoxyphenyl)carbamothioyl]pyrazine-2-carboxamide CAS Name: N-[(3-phenoxyanilino)-sulfanylidenemethyl]-2-pyrazinecarboxamide IUPAC Name: N-[(3-phenoxyphenyl)carbamothioyl]pyrazine-2-carboxamide Traditional Name: N-[(3-phenoxyphenyl)thiocarbamoyl]pyrazinamide Formula: C18H14N4O2S MolecularWeight: 350.39436

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=CC(=C2)NC(=S)NC(=O)C3=NC=CN=C3

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=CC(=C2)NC(=S)NC(=O)C3=NC=CN=C3

InChI

InChI=1S/C18H14N4O2S/c23-17(16-12-19-9-10-20-16)22-18(25)21-13-5-4-8-15(11-13)24-14-6-2-1-3-7-14/h1-12H,(H2,21,22,23,25)