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

Systemtic Name: 3-[4-cyclopropyl-5-[2-(3-methyl-4-propan-2-yl-phenoxy)ethylsulfanyl]-1,2,4-triazol-3-yl]propanamide Openeye Name: 3-[4-cyclopropyl-5-[2-(4-isopropyl-3-methyl-phenoxy)ethylsulfanyl]-1,2,4-triazol-3-yl]propanamide CAS Name: 3-[4-cyclopropyl-5-[2-(3-methyl-4-propan-2-ylphenoxy)ethylthio]-1,2,4-triazol-3-yl]propanamide IUPAC Name: 3-[4-cyclopropyl-5-[2-(3-methyl-4-propan-2-ylphenoxy)ethylsulfanyl]-1,2,4-triazol-3-yl]propanamide Traditional Name: 3-[4-cyclopropyl-5-[2-(4-isopropyl-3-methyl-phenoxy)ethylthio]-1,2,4-triazol-3-yl]propionamide Formula: C20H28N4O2S MolecularWeight: 388.52692

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H28N4O2S/c1-13(2)17-7-6-16(12-14(17)3)26-10-11-27-20-23-22-19(9-8-18(21)25)24(20)15-4-5-15/h6-7,12-13,15H,4-5,8-11H2,1-3H3,(H2,21,25)