N,N-diethyl-4-[[5-(2-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]butanamide

Systemtic Name: N,N-diethyl-4-[[5-(2-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]butanamide Openeye Name: N,N-diethyl-4-[[5-(2-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]butanamide CAS Name: N,N-diethyl-4-[[5-(2-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]thio]butanamide IUPAC Name: N,N-diethyl-4-[[5-(2-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]butanamide Traditional Name: N,N-diethyl-4-[[5-(2-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]thio]butyramide Formula: C23H28N4O2S MolecularWeight: 424.55902

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)CCCSC1=NN=C(N1C2=CC=CC=C2)C3=CC=CC=C3OC

Isomeric SMILES

CCN(CC)C(=O)CCCSC1=NN=C(N1C2=CC=CC=C2)C3=CC=CC=C3OC

InChI

InChI=1S/C23H28N4O2S/c1-4-26(5-2)21(28)16-11-17-30-23-25-24-22(19-14-9-10-15-20(19)29-3)27(23)18-12-7-6-8-13-18/h6-10,12-15H,4-5,11,16-17H2,1-3H3