N-[1-[5-(cyclohexylmethylsulfanyl)-4-methyl-1,2,4-triazol-3-yl]-2-phenyl-ethyl]-2,5-dimethoxy-benzamide

Systemtic Name: N-[1-[5-(cyclohexylmethylsulfanyl)-4-methyl-1,2,4-triazol-3-yl]-2-phenyl-ethyl]-2,5-dimethoxy-benzamide Openeye Name: N-[1-[5-(cyclohexylmethylsulfanyl)-4-methyl-1,2,4-triazol-3-yl]-2-phenyl-ethyl]-2,5-dimethoxy-benzamide CAS Name: N-[1-[5-(cyclohexylmethylthio)-4-methyl-1,2,4-triazol-3-yl]-2-phenylethyl]-2,5-dimethoxybenzamide IUPAC Name: N-[1-[5-(cyclohexylmethylsulfanyl)-4-methyl-1,2,4-triazol-3-yl]-2-phenylethyl]-2,5-dimethoxybenzamide Traditional Name: N-[1-[5-(cyclohexylmethylthio)-4-methyl-1,2,4-triazol-3-yl]-2-phenyl-ethyl]-2,5-dimethoxy-benzamide Formula: C27H34N4O3S MolecularWeight: 494.64886

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2CCCCC2)C(CC3=CC=CC=C3)NC(=O)C4=C(C=CC(=C4)OC)OC

Isomeric SMILES

CN1C(=NN=C1SCC2CCCCC2)C(CC3=CC=CC=C3)NC(=O)C4=C(C=CC(=C4)OC)OC

InChI

InChI=1S/C27H34N4O3S/c1-31-25(29-30-27(31)35-18-20-12-8-5-9-13-20)23(16-19-10-6-4-7-11-19)28-26(32)22-17-21(33-2)14-15-24(22)34-3/h4,6-7,10-11,14-15,17,20,23H,5,8-9,12-13,16,18H2,1-3H3,(H,28,32)