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

Systemtic Name: N-[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propyl]-4-propan-2-yl-benzamide Openeye Name: N-[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propyl]-4-isopropyl-benzamide CAS Name: N-[3-[4-cyclopentyl-5-(methylthio)-1,2,4-triazol-3-yl]propyl]-4-propan-2-ylbenzamide IUPAC Name: N-[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propyl]-4-propan-2-ylbenzamide Traditional Name: N-[3-[4-cyclopentyl-5-(methylthio)-1,2,4-triazol-3-yl]propyl]-4-isopropyl-benzamide Formula: C21H30N4OS MolecularWeight: 386.5541

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H30N4OS/c1-15(2)16-10-12-17(13-11-16)20(26)22-14-6-9-19-23-24-21(27-3)25(19)18-7-4-5-8-18/h10-13,15,18H,4-9,14H2,1-3H3,(H,22,26)