2-(6-phenylpyrimidin-4-yl)sulfanyl-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)butanamide

Systemtic Name: 2-(6-phenylpyrimidin-4-yl)sulfanyl-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)butanamide Openeye Name: N-(5-isopropyl-1,3,4-thiadiazol-2-yl)-2-(6-phenylpyrimidin-4-yl)sulfanyl-butanamide CAS Name: 2-[(6-phenyl-4-pyrimidinyl)thio]-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)butanamide IUPAC Name: 2-(6-phenylpyrimidin-4-yl)sulfanyl-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)butanamide Traditional Name: N-(5-isopropyl-1,3,4-thiadiazol-2-yl)-2-[(6-phenylpyrimidin-4-yl)thio]butyramide Formula: C19H21N5OS2 MolecularWeight: 399.53294

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21N5OS2/c1-4-15(17(25)22-19-24-23-18(27-19)12(2)3)26-16-10-14(20-11-21-16)13-8-6-5-7-9-13/h5-12,15H,4H2,1-3H3,(H,22,24,25)