N-(2-hydroxyethyl)-3-[[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-3-thiophen-2-yl-propanamide

Systemtic Name: N-(2-hydroxyethyl)-3-[[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-3-thiophen-2-yl-propanamide Openeye Name: N-(2-hydroxyethyl)-3-[[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-3-(2-thienyl)propanamide CAS Name: N-(2-hydroxyethyl)-3-[[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]thio]-3-thiophen-2-ylpropanamide IUPAC Name: N-(2-hydroxyethyl)-3-[[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-3-thiophen-2-ylpropanamide Traditional Name: N-(2-hydroxyethyl)-3-[[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]thio]-3-(2-thienyl)propionamide Formula: C18H20N4O3S2 MolecularWeight: 404.5064

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC(=NN2)SC(CC(=O)NCCO)C3=CC=CS3

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC(=NN2)SC(CC(=O)NCCO)C3=CC=CS3

InChI

InChI=1S/C18H20N4O3S2/c1-25-13-6-4-12(5-7-13)17-20-18(22-21-17)27-15(14-3-2-10-26-14)11-16(24)19-8-9-23/h2-7,10,15,23H,8-9,11H2,1H3,(H,19,24)(H,20,21,22)