2-[[4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenethyl-propanamide

Systemtic Name: 2-[[4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenethyl-propanamide Openeye Name: 2-[[4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenethyl-propanamide CAS Name: 2-[[4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]thio]-N-phenethylpropanamide IUPAC Name: 2-[[4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenethylpropanamide Traditional Name: 2-[[4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]thio]-N-phenethyl-propionamide Formula: C20H22N4O2S MolecularWeight: 382.47928

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCC1=CC=CC=C1)SC2=NN=CN2C3=CC(=CC=C3)OC

Isomeric SMILES

CC(C(=O)NCCC1=CC=CC=C1)SC2=NN=CN2C3=CC(=CC=C3)OC

InChI

InChI=1S/C20H22N4O2S/c1-15(19(25)21-12-11-16-7-4-3-5-8-16)27-20-23-22-14-24(20)17-9-6-10-18(13-17)26-2/h3-10,13-15H,11-12H2,1-2H3,(H,21,25)