N-(3-chloranyl-2-methyl-phenyl)-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanamide

Systemtic Name: N-(3-chloranyl-2-methyl-phenyl)-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: N-(3-chloro-2-methyl-phenyl)-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanamide CAS Name: N-(3-chloro-2-methylphenyl)-2-[(4-phenyl-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: N-(3-chloro-2-methylphenyl)-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: N-(3-chloro-2-methyl-phenyl)-2-[(4-phenyl-1,2,4-triazol-3-yl)thio]propionamide Formula: C18H17ClN4OS MolecularWeight: 372.87178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)C(C)SC2=NN=CN2C3=CC=CC=C3

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)C(C)SC2=NN=CN2C3=CC=CC=C3

InChI

InChI=1S/C18H17ClN4OS/c1-12-15(19)9-6-10-16(12)21-17(24)13(2)25-18-22-20-11-23(18)14-7-4-3-5-8-14/h3-11,13H,1-2H3,(H,21,24)