N-[3-[(4-chloranylphenoxy)methyl]-5-sulfanylidene-1H-1,2,4-triazol-4-yl]pyrazine-2-carboxamide

Systemtic Name: N-[3-[(4-chloranylphenoxy)methyl]-5-sulfanylidene-1H-1,2,4-triazol-4-yl]pyrazine-2-carboxamide Openeye Name: N-[3-[(4-chlorophenoxy)methyl]-5-thioxo-1H-1,2,4-triazol-4-yl]pyrazine-2-carboxamide CAS Name: N-[3-[(4-chlorophenoxy)methyl]-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-2-pyrazinecarboxamide IUPAC Name: N-[3-[(4-chlorophenoxy)methyl]-5-sulfanylidene-1H-1,2,4-triazol-4-yl]pyrazine-2-carboxamide Traditional Name: N-[3-[(4-chlorophenoxy)methyl]-5-thioxo-1H-1,2,4-triazol-4-yl]pyrazinamide Formula: C14H11ClN6O2S MolecularWeight: 362.79414

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OCC2=NNC(=S)N2NC(=O)C3=NC=CN=C3)Cl

Isomeric SMILES

C1=CC(=CC=C1OCC2=NNC(=S)N2NC(=O)C3=NC=CN=C3)Cl

InChI

InChI=1S/C14H11ClN6O2S/c15-9-1-3-10(4-2-9)23-8-12-18-19-14(24)21(12)20-13(22)11-7-16-5-6-17-11/h1-7H,8H2,(H,19,24)(H,20,22)