N-(3-chloranyl-4-methyl-phenyl)-2-phenyl-2-[(4-propyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-2-phenyl-2-[(4-propyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(3-chloro-4-methyl-phenyl)-2-phenyl-2-[[4-propyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(3-chloro-4-methylphenyl)-2-phenyl-2-[(4-propyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(3-chloro-4-methylphenyl)-2-phenyl-2-[(4-propyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(3-chloro-4-methyl-phenyl)-2-phenyl-2-[[4-propyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C25H24ClN5OS MolecularWeight: 478.00896

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN=C1SC(C2=CC=CC=C2)C(=O)NC3=CC(=C(C=C3)C)Cl)C4=CC=NC=C4

Isomeric SMILES

CCCN1C(=NN=C1SC(C2=CC=CC=C2)C(=O)NC3=CC(=C(C=C3)C)Cl)C4=CC=NC=C4

InChI

InChI=1S/C25H24ClN5OS/c1-3-15-31-23(19-11-13-27-14-12-19)29-30-25(31)33-22(18-7-5-4-6-8-18)24(32)28-20-10-9-17(2)21(26)16-20/h4-14,16,22H,3,15H2,1-2H3,(H,28,32)