3-[3-cyclopropyl-5-[(2-phenoxyphenyl)methylsulfanyl]-1,2,4-triazol-4-yl]propanamide

Systemtic Name: 3-[3-cyclopropyl-5-[(2-phenoxyphenyl)methylsulfanyl]-1,2,4-triazol-4-yl]propanamide Openeye Name: 3-[3-cyclopropyl-5-[(2-phenoxyphenyl)methylsulfanyl]-1,2,4-triazol-4-yl]propanamide CAS Name: 3-[3-cyclopropyl-5-[(2-phenoxyphenyl)methylthio]-1,2,4-triazol-4-yl]propanamide IUPAC Name: 3-[3-cyclopropyl-5-[(2-phenoxyphenyl)methylsulfanyl]-1,2,4-triazol-4-yl]propanamide Traditional Name: 3-[3-cyclopropyl-5-[(2-phenoxybenzyl)thio]-1,2,4-triazol-4-yl]propionamide Formula: C21H22N4O2S MolecularWeight: 394.48998

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NN=C(N2CCC(=O)N)SCC3=CC=CC=C3OC4=CC=CC=C4

Isomeric SMILES

C1CC1C2=NN=C(N2CCC(=O)N)SCC3=CC=CC=C3OC4=CC=CC=C4

InChI

InChI=1S/C21H22N4O2S/c22-19(26)12-13-25-20(15-10-11-15)23-24-21(25)28-14-16-6-4-5-9-18(16)27-17-7-2-1-3-8-17/h1-9,15H,10-14H2,(H2,22,26)