4-methoxy-N-[(5-phenacylsulfanyl-4-phenethyl-1,2,4-triazol-3-yl)methyl]benzamide

Systemtic Name: 4-methoxy-N-[(5-phenacylsulfanyl-4-phenethyl-1,2,4-triazol-3-yl)methyl]benzamide Openeye Name: 4-methoxy-N-[(5-phenacylsulfanyl-4-phenethyl-1,2,4-triazol-3-yl)methyl]benzamide CAS Name: 4-methoxy-N-[[5-(phenacylthio)-4-phenethyl-1,2,4-triazol-3-yl]methyl]benzamide IUPAC Name: 4-methoxy-N-[(5-phenacylsulfanyl-4-phenethyl-1,2,4-triazol-3-yl)methyl]benzamide Traditional Name: 4-methoxy-N-[[5-(phenacylthio)-4-phenethyl-1,2,4-triazol-3-yl]methyl]benzamide Formula: C27H26N4O3S MolecularWeight: 486.58534

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NCC2=NN=C(N2CCC3=CC=CC=C3)SCC(=O)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NCC2=NN=C(N2CCC3=CC=CC=C3)SCC(=O)C4=CC=CC=C4

InChI

InChI=1S/C27H26N4O3S/c1-34-23-14-12-22(13-15-23)26(33)28-18-25-29-30-27(31(25)17-16-20-8-4-2-5-9-20)35-19-24(32)21-10-6-3-7-11-21/h2-15H,16-19H2,1H3,(H,28,33)