N-[2,6-bis(chloranyl)-3-methyl-phenyl]-2-[(4-pyrazol-1-ylphenyl)methylsulfanyl]ethanamide

Systemtic Name: N-[2,6-bis(chloranyl)-3-methyl-phenyl]-2-[(4-pyrazol-1-ylphenyl)methylsulfanyl]ethanamide Openeye Name: N-(2,6-dichloro-3-methyl-phenyl)-2-[(4-pyrazol-1-ylphenyl)methylsulfanyl]acetamide CAS Name: N-(2,6-dichloro-3-methylphenyl)-2-[[4-(1-pyrazolyl)phenyl]methylthio]acetamide IUPAC Name: N-(2,6-dichloro-3-methylphenyl)-2-[(4-pyrazol-1-ylphenyl)methylsulfanyl]acetamide Traditional Name: N-(2,6-dichloro-3-methyl-phenyl)-2-[(4-pyrazol-1-ylbenzyl)thio]acetamide Formula: C19H17Cl2N3OS MolecularWeight: 406.32878

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)Cl)NC(=O)CSCC2=CC=C(C=C2)N3C=CC=N3)Cl

Isomeric SMILES

CC1=C(C(=C(C=C1)Cl)NC(=O)CSCC2=CC=C(C=C2)N3C=CC=N3)Cl

InChI

InChI=1S/C19H17Cl2N3OS/c1-13-3-8-16(20)19(18(13)21)23-17(25)12-26-11-14-4-6-15(7-5-14)24-10-2-9-22-24/h2-10H,11-12H2,1H3,(H,23,25)