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

Systemtic Name: N-(2-methoxy-5-methyl-phenyl)-2-[(4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: 2-[(4-allyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methoxy-5-methyl-phenyl)propanamide CAS Name: N-(2-methoxy-5-methylphenyl)-2-[(4-prop-2-enyl-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: N-(2-methoxy-5-methylphenyl)-2-[(4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: 2-[(4-allyl-1,2,4-triazol-3-yl)thio]-N-(2-methoxy-5-methyl-phenyl)propionamide Formula: C16H20N4O2S MolecularWeight: 332.4206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=O)C(C)SC2=NN=CN2CC=C

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=O)C(C)SC2=NN=CN2CC=C

InChI

InChI=1S/C16H20N4O2S/c1-5-8-20-10-17-19-16(20)23-12(3)15(21)18-13-9-11(2)6-7-14(13)22-4/h5-7,9-10,12H,1,8H2,2-4H3,(H,18,21)