N-(2-phenylpropyl)-2-[(4-phenyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]propanamide

Systemtic Name: N-(2-phenylpropyl)-2-[(4-phenyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: N-(2-phenylpropyl)-2-[[4-phenyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: N-(2-phenylpropyl)-2-[(4-phenyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: N-(2-phenylpropyl)-2-[(4-phenyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: N-(2-phenylpropyl)-2-[[4-phenyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]propionamide Formula: C25H25N5OS MolecularWeight: 443.5639

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)C(C)SC1=NN=C(N1C2=CC=CC=C2)C3=CC=NC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(CNC(=O)C(C)SC1=NN=C(N1C2=CC=CC=C2)C3=CC=NC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H25N5OS/c1-18(20-9-5-3-6-10-20)17-27-24(31)19(2)32-25-29-28-23(21-13-15-26-16-14-21)30(25)22-11-7-4-8-12-22/h3-16,18-19H,17H2,1-2H3,(H,27,31)