3,5-bis(chloranyl)-N-[(3-ethylsulfanyl-5-methyl-1,2,4-triazol-4-yl)carbamothioyl]-4-methoxy-benzamide

Systemtic Name: 3,5-bis(chloranyl)-N-[(3-ethylsulfanyl-5-methyl-1,2,4-triazol-4-yl)carbamothioyl]-4-methoxy-benzamide Openeye Name: 3,5-dichloro-N-[(3-ethylsulfanyl-5-methyl-1,2,4-triazol-4-yl)carbamothioyl]-4-methoxy-benzamide CAS Name: 3,5-dichloro-N-[[[3-(ethylthio)-5-methyl-1,2,4-triazol-4-yl]amino]-sulfanylidenemethyl]-4-methoxybenzamide IUPAC Name: 3,5-dichloro-N-[(3-ethylsulfanyl-5-methyl-1,2,4-triazol-4-yl)carbamothioyl]-4-methoxybenzamide Traditional Name: 3,5-dichloro-N-[[3-(ethylthio)-5-methyl-1,2,4-triazol-4-yl]thiocarbamoyl]-4-methoxy-benzamide Formula: C14H15Cl2N5O2S2 MolecularWeight: 420.3372

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C(N1NC(=S)NC(=O)C2=CC(=C(C(=C2)Cl)OC)Cl)C

Isomeric SMILES

CCSC1=NN=C(N1NC(=S)NC(=O)C2=CC(=C(C(=C2)Cl)OC)Cl)C

InChI

InChI=1S/C14H15Cl2N5O2S2/c1-4-25-14-19-18-7(2)21(14)20-13(24)17-12(22)8-5-9(15)11(23-3)10(16)6-8/h5-6H,4H2,1-3H3,(H2,17,20,22,24)