2-[(2-methylphenyl)methylsulfanyl]-N-(5-methyl-1,3,4-thiadiazol-2-yl)-5-phenylsulfanyl-pyrimidine-4-carboxamide

Systemtic Name: 2-[(2-methylphenyl)methylsulfanyl]-N-(5-methyl-1,3,4-thiadiazol-2-yl)-5-phenylsulfanyl-pyrimidine-4-carboxamide Openeye Name: N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-(o-tolylmethylsulfanyl)-5-phenylsulfanyl-pyrimidine-4-carboxamide CAS Name: 2-[(2-methylphenyl)methylthio]-N-(5-methyl-1,3,4-thiadiazol-2-yl)-5-(phenylthio)-4-pyrimidinecarboxamide IUPAC Name: 2-[(2-methylphenyl)methylsulfanyl]-N-(5-methyl-1,3,4-thiadiazol-2-yl)-5-phenylsulfanylpyrimidine-4-carboxamide Traditional Name: 2-[(2-methylbenzyl)thio]-N-(5-methyl-1,3,4-thiadiazol-2-yl)-5-(phenylthio)pyrimidine-4-carboxamide Formula: C22H19N5OS3 MolecularWeight: 465.61416

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSC2=NC=C(C(=N2)C(=O)NC3=NN=C(S3)C)SC4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC=C1CSC2=NC=C(C(=N2)C(=O)NC3=NN=C(S3)C)SC4=CC=CC=C4

InChI

InChI=1S/C22H19N5OS3/c1-14-8-6-7-9-16(14)13-29-21-23-12-18(31-17-10-4-3-5-11-17)19(24-21)20(28)25-22-27-26-15(2)30-22/h3-12H,13H2,1-2H3,(H,25,27,28)