N-(4-methoxyphenyl)-5-[(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylmethyl]-1,3,4-thiadiazole-2-carboxamide

Systemtic Name: N-(4-methoxyphenyl)-5-[(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylmethyl]-1,3,4-thiadiazole-2-carboxamide Openeye Name: N-(4-methoxyphenyl)-5-[(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylmethyl]-1,3,4-thiadiazole-2-carboxamide CAS Name: N-(4-methoxyphenyl)-5-[[(4-methyl-6-phenyl-2-pyrimidinyl)thio]methyl]-1,3,4-thiadiazole-2-carboxamide IUPAC Name: N-(4-methoxyphenyl)-5-[(4-methyl-6-phenylpyrimidin-2-yl)sulfanylmethyl]-1,3,4-thiadiazole-2-carboxamide Traditional Name: N-(4-methoxyphenyl)-5-[[(4-methyl-6-phenyl-pyrimidin-2-yl)thio]methyl]-1,3,4-thiadiazole-2-carboxamide Formula: C22H19N5O2S2 MolecularWeight: 449.54856

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC3=NN=C(S3)C(=O)NC4=CC=C(C=C4)OC

Isomeric SMILES

CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC3=NN=C(S3)C(=O)NC4=CC=C(C=C4)OC

InChI

InChI=1S/C22H19N5O2S2/c1-14-12-18(15-6-4-3-5-7-15)25-22(23-14)30-13-19-26-27-21(31-19)20(28)24-16-8-10-17(29-2)11-9-16/h3-12H,13H2,1-2H3,(H,24,28)