N-[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propyl]-3-(4-methylphenoxy)propanamide

Systemtic Name: N-[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propyl]-3-(4-methylphenoxy)propanamide Openeye Name: N-[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propyl]-3-(4-methylphenoxy)propanamide CAS Name: N-[3-[4-cyclopentyl-5-(methylthio)-1,2,4-triazol-3-yl]propyl]-3-(4-methylphenoxy)propanamide IUPAC Name: N-[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propyl]-3-(4-methylphenoxy)propanamide Traditional Name: N-[3-[4-cyclopentyl-5-(methylthio)-1,2,4-triazol-3-yl]propyl]-3-(4-methylphenoxy)propionamide Formula: C21H30N4O2S MolecularWeight: 402.5535

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCCC(=O)NCCCC2=NN=C(N2C3CCCC3)SC

Isomeric SMILES

CC1=CC=C(C=C1)OCCC(=O)NCCCC2=NN=C(N2C3CCCC3)SC

InChI

InChI=1S/C21H30N4O2S/c1-16-9-11-18(12-10-16)27-15-13-20(26)22-14-5-8-19-23-24-21(28-2)25(19)17-6-3-4-7-17/h9-12,17H,3-8,13-15H2,1-2H3,(H,22,26)