N-ethoxy-2-[[4-phenyl-5-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-thiazole-4-carboxamide

Systemtic Name: N-ethoxy-2-[[4-phenyl-5-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-thiazole-4-carboxamide Openeye Name: 2-[(5-benzyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-N-ethoxy-thiazole-4-carboxamide CAS Name: N-ethoxy-2-[[[4-phenyl-5-(phenylmethyl)-1,2,4-triazol-3-yl]thio]methyl]-4-thiazolecarboxamide IUPAC Name: 2-[(5-benzyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-N-ethoxy-1,3-thiazole-4-carboxamide Traditional Name: 2-[[(5-benzyl-4-phenyl-1,2,4-triazol-3-yl)thio]methyl]-N-ethoxy-thiazole-4-carboxamide Formula: C22H21N5O2S2 MolecularWeight: 451.56444

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Descriptors Computed from Structure

Canonical SMILES:

CCONC(=O)C1=CSC(=N1)CSC2=NN=C(N2C3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

CCONC(=O)C1=CSC(=N1)CSC2=NN=C(N2C3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C22H21N5O2S2/c1-2-29-26-21(28)18-14-30-20(23-18)15-31-22-25-24-19(13-16-9-5-3-6-10-16)27(22)17-11-7-4-8-12-17/h3-12,14H,2,13,15H2,1H3,(H,26,28)