2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-N-propan-2-yl-1,3-oxazole-4-carboxamide

Systemtic Name: 2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-N-propan-2-yl-1,3-oxazole-4-carboxamide Openeye Name: 2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-N-isopropyl-oxazole-4-carboxamide CAS Name: 2-[[(4,5-diphenyl-1,2,4-triazol-3-yl)thio]methyl]-N-propan-2-yl-4-oxazolecarboxamide IUPAC Name: 2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-N-propan-2-yl-1,3-oxazole-4-carboxamide Traditional Name: 2-[[(4,5-diphenyl-1,2,4-triazol-3-yl)thio]methyl]-N-isopropyl-oxazole-4-carboxamide Formula: C22H21N5O2S MolecularWeight: 419.49944

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1=COC(=N1)CSC2=NN=C(N2C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)NC(=O)C1=COC(=N1)CSC2=NN=C(N2C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H21N5O2S/c1-15(2)23-21(28)18-13-29-19(24-18)14-30-22-26-25-20(16-9-5-3-6-10-16)27(22)17-11-7-4-8-12-17/h3-13,15H,14H2,1-2H3,(H,23,28)