[2-[(4-azanyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methoxy]-5-chloranyl-phenyl]-phenyl-methanone

Systemtic Name: [2-[(4-azanyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methoxy]-5-chloranyl-phenyl]-phenyl-methanone Openeye Name: [2-[(4-amino-5-thioxo-1H-1,2,4-triazol-3-yl)methoxy]-5-chloro-phenyl]-phenyl-methanone CAS Name: [2-[(4-amino-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methoxy]-5-chlorophenyl]-phenylmethanone IUPAC Name: [2-[(4-amino-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methoxy]-5-chlorophenyl]-phenylmethanone Traditional Name: [2-[(4-amino-5-thioxo-1H-1,2,4-triazol-3-yl)methoxy]-5-chloro-phenyl]-phenyl-methanone Formula: C16H13ClN4O2S MolecularWeight: 360.81802

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=C(C=CC(=C2)Cl)OCC3=NNC(=S)N3N

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=C(C=CC(=C2)Cl)OCC3=NNC(=S)N3N

InChI

InChI=1S/C16H13ClN4O2S/c17-11-6-7-13(23-9-14-19-20-16(24)21(14)18)12(8-11)15(22)10-4-2-1-3-5-10/h1-8H,9,18H2,(H,20,24)