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

Systemtic Name: N-[[5-[(4-methoxyphenyl)methylsulfanyl]-4-propan-2-yl-1,2,4-triazol-3-yl]methyl]-2-methyl-benzamide Openeye Name: N-[[4-isopropyl-5-[(4-methoxyphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]methyl]-2-methyl-benzamide CAS Name: N-[[5-[(4-methoxyphenyl)methylthio]-4-propan-2-yl-1,2,4-triazol-3-yl]methyl]-2-methylbenzamide IUPAC Name: N-[[5-[(4-methoxyphenyl)methylsulfanyl]-4-propan-2-yl-1,2,4-triazol-3-yl]methyl]-2-methylbenzamide Traditional Name: N-[[4-isopropyl-5-(p-anisylthio)-1,2,4-triazol-3-yl]methyl]-2-methyl-benzamide Formula: C22H26N4O2S MolecularWeight: 410.53244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NCC2=NN=C(N2C(C)C)SCC3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC=CC=C1C(=O)NCC2=NN=C(N2C(C)C)SCC3=CC=C(C=C3)OC

InChI

InChI=1S/C22H26N4O2S/c1-15(2)26-20(13-23-21(27)19-8-6-5-7-16(19)3)24-25-22(26)29-14-17-9-11-18(28-4)12-10-17/h5-12,15H,13-14H2,1-4H3,(H,23,27)