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

Systemtic Name: 2-[[4-(3-chloranyl-4-methyl-phenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-prop-2-enyl-propanamide Openeye Name: N-allyl-2-[[4-(3-chloro-4-methyl-phenyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: 2-[[4-(3-chloro-4-methylphenyl)-1,2,4-triazol-3-yl]thio]-N-prop-2-enylpropanamide IUPAC Name: 2-[[4-(3-chloro-4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-prop-2-enylpropanamide Traditional Name: N-allyl-2-[[4-(3-chloro-4-methyl-phenyl)-1,2,4-triazol-3-yl]thio]propionamide Formula: C15H17ClN4OS MolecularWeight: 336.83968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C=NN=C2SC(C)C(=O)NCC=C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2C=NN=C2SC(C)C(=O)NCC=C)Cl

InChI

InChI=1S/C15H17ClN4OS/c1-4-7-17-14(21)11(3)22-15-19-18-9-20(15)12-6-5-10(2)13(16)8-12/h4-6,8-9,11H,1,7H2,2-3H3,(H,17,21)