3-[3-[2-(3-methylphenoxy)ethylsulfanyl]-5-thiophen-2-yl-1,2,4-triazol-4-yl]propanamide

Systemtic Name: 3-[3-[2-(3-methylphenoxy)ethylsulfanyl]-5-thiophen-2-yl-1,2,4-triazol-4-yl]propanamide Openeye Name: 3-[3-[2-(3-methylphenoxy)ethylsulfanyl]-5-(2-thienyl)-1,2,4-triazol-4-yl]propanamide CAS Name: 3-[3-[2-(3-methylphenoxy)ethylthio]-5-thiophen-2-yl-1,2,4-triazol-4-yl]propanamide IUPAC Name: 3-[3-[2-(3-methylphenoxy)ethylsulfanyl]-5-thiophen-2-yl-1,2,4-triazol-4-yl]propanamide Traditional Name: 3-[3-[2-(3-methylphenoxy)ethylthio]-5-(2-thienyl)-1,2,4-triazol-4-yl]propionamide Formula: C18H20N4O2S2 MolecularWeight: 388.507

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCSC2=NN=C(N2CCC(=O)N)C3=CC=CS3

Isomeric SMILES

CC1=CC(=CC=C1)OCCSC2=NN=C(N2CCC(=O)N)C3=CC=CS3

InChI

InChI=1S/C18H20N4O2S2/c1-13-4-2-5-14(12-13)24-9-11-26-18-21-20-17(15-6-3-10-25-15)22(18)8-7-16(19)23/h2-6,10,12H,7-9,11H2,1H3,(H2,19,23)