N-(4-ethoxyphenyl)-2-[[4-phenyl-5-(phenylazanylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-(4-ethoxyphenyl)-2-[[4-phenyl-5-(phenylazanylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: 2-[[5-(anilinomethyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-ethoxyphenyl)acetamide CAS Name: 2-[[5-(anilinomethyl)-4-phenyl-1,2,4-triazol-3-yl]thio]-N-(4-ethoxyphenyl)acetamide IUPAC Name: 2-[[5-(anilinomethyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-ethoxyphenyl)acetamide Traditional Name: 2-[[5-(anilinomethyl)-4-phenyl-1,2,4-triazol-3-yl]thio]-N-p-phenetyl-acetamide Formula: C25H25N5O2S MolecularWeight: 459.5633

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2C3=CC=CC=C3)CNC4=CC=CC=C4

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2C3=CC=CC=C3)CNC4=CC=CC=C4

InChI

InChI=1S/C25H25N5O2S/c1-2-32-22-15-13-20(14-16-22)27-24(31)18-33-25-29-28-23(17-26-19-9-5-3-6-10-19)30(25)21-11-7-4-8-12-21/h3-16,26H,2,17-18H2,1H3,(H,27,31)