2-(2-methyl-6-phenyl-pyrimidin-4-yl)sulfanyl-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]butanamide

Systemtic Name: 2-(2-methyl-6-phenyl-pyrimidin-4-yl)sulfanyl-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]butanamide Openeye Name: N-(5-isobutyl-1,3,4-thiadiazol-2-yl)-2-(2-methyl-6-phenyl-pyrimidin-4-yl)sulfanyl-butanamide CAS Name: 2-[(2-methyl-6-phenyl-4-pyrimidinyl)thio]-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]butanamide IUPAC Name: 2-(2-methyl-6-phenylpyrimidin-4-yl)sulfanyl-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]butanamide Traditional Name: N-(5-isobutyl-1,3,4-thiadiazol-2-yl)-2-[(2-methyl-6-phenyl-pyrimidin-4-yl)thio]butyramide Formula: C21H25N5OS2 MolecularWeight: 427.5861

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=NN=C(S1)CC(C)C)SC2=NC(=NC(=C2)C3=CC=CC=C3)C

Isomeric SMILES

CCC(C(=O)NC1=NN=C(S1)CC(C)C)SC2=NC(=NC(=C2)C3=CC=CC=C3)C

InChI

InChI=1S/C21H25N5OS2/c1-5-17(20(27)24-21-26-25-19(29-21)11-13(2)3)28-18-12-16(22-14(4)23-18)15-9-7-6-8-10-15/h6-10,12-13,17H,5,11H2,1-4H3,(H,24,26,27)