N-(5-chloranyl-2-methyl-phenyl)-2-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]propanamide

Systemtic Name: N-(5-chloranyl-2-methyl-phenyl)-2-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: 2-[(4-allyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(5-chloro-2-methyl-phenyl)propanamide CAS Name: N-(5-chloro-2-methylphenyl)-2-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: N-(5-chloro-2-methylphenyl)-2-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: 2-[(4-allyl-5-methyl-1,2,4-triazol-3-yl)thio]-N-(5-chloro-2-methyl-phenyl)propionamide Formula: C16H19ClN4OS MolecularWeight: 350.86626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)NC(=O)C(C)SC2=NN=C(N2CC=C)C

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)NC(=O)C(C)SC2=NN=C(N2CC=C)C

InChI

InChI=1S/C16H19ClN4OS/c1-5-8-21-12(4)19-20-16(21)23-11(3)15(22)18-14-9-13(17)7-6-10(14)2/h5-7,9,11H,1,8H2,2-4H3,(H,18,22)