N-(3-chloranyl-2-methyl-phenyl)-3-(ethylsulfanylmethyl)-5-(4-methoxyphenyl)-1,2,3-triazole-4-carboxamide

Systemtic Name: N-(3-chloranyl-2-methyl-phenyl)-3-(ethylsulfanylmethyl)-5-(4-methoxyphenyl)-1,2,3-triazole-4-carboxamide Openeye Name: N-(3-chloro-2-methyl-phenyl)-3-(ethylsulfanylmethyl)-5-(4-methoxyphenyl)triazole-4-carboxamide CAS Name: N-(3-chloro-2-methylphenyl)-3-[(ethylthio)methyl]-5-(4-methoxyphenyl)-4-triazolecarboxamide IUPAC Name: N-(3-chloro-2-methylphenyl)-3-(ethylsulfanylmethyl)-5-(4-methoxyphenyl)triazole-4-carboxamide Traditional Name: N-(3-chloro-2-methyl-phenyl)-3-[(ethylthio)methyl]-5-(4-methoxyphenyl)triazole-4-carboxamide Formula: C20H21ClN4O2S MolecularWeight: 416.92434

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Descriptors Computed from Structure

Canonical SMILES:

CCSCN1C(=C(N=N1)C2=CC=C(C=C2)OC)C(=O)NC3=C(C(=CC=C3)Cl)C

Isomeric SMILES

CCSCN1C(=C(N=N1)C2=CC=C(C=C2)OC)C(=O)NC3=C(C(=CC=C3)Cl)C

InChI

InChI=1S/C20H21ClN4O2S/c1-4-28-12-25-19(20(26)22-17-7-5-6-16(21)13(17)2)18(23-24-25)14-8-10-15(27-3)11-9-14/h5-11H,4,12H2,1-3H3,(H,22,26)