3-[4-cyclopropyl-5-[2-(2,5-dimethylphenoxy)ethylsulfanyl]-1,2,4-triazol-3-yl]propanamide

Systemtic Name: 3-[4-cyclopropyl-5-[2-(2,5-dimethylphenoxy)ethylsulfanyl]-1,2,4-triazol-3-yl]propanamide Openeye Name: 3-[4-cyclopropyl-5-[2-(2,5-dimethylphenoxy)ethylsulfanyl]-1,2,4-triazol-3-yl]propanamide CAS Name: 3-[4-cyclopropyl-5-[2-(2,5-dimethylphenoxy)ethylthio]-1,2,4-triazol-3-yl]propanamide IUPAC Name: 3-[4-cyclopropyl-5-[2-(2,5-dimethylphenoxy)ethylsulfanyl]-1,2,4-triazol-3-yl]propanamide Traditional Name: 3-[4-cyclopropyl-5-[2-(2,5-dimethylphenoxy)ethylthio]-1,2,4-triazol-3-yl]propionamide Formula: C18H24N4O2S MolecularWeight: 360.47376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OCCSC2=NN=C(N2C3CC3)CCC(=O)N

Isomeric SMILES

CC1=CC(=C(C=C1)C)OCCSC2=NN=C(N2C3CC3)CCC(=O)N

InChI

InChI=1S/C18H24N4O2S/c1-12-3-4-13(2)15(11-12)24-9-10-25-18-21-20-17(8-7-16(19)23)22(18)14-5-6-14/h3-4,11,14H,5-10H2,1-2H3,(H2,19,23)