N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-4-oxidanylidene-4-(4-pyrimidin-2-ylpiperazin-1-yl)butanamide

Systemtic Name: N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-4-oxidanylidene-4-(4-pyrimidin-2-ylpiperazin-1-yl)butanamide Openeye Name: N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-4-oxo-4-(4-pyrimidin-2-ylpiperazin-1-yl)butanamide CAS Name: N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-4-oxo-4-[4-(2-pyrimidinyl)-1-piperazinyl]butanamide IUPAC Name: N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-4-oxo-4-(4-pyrimidin-2-ylpiperazin-1-yl)butanamide Traditional Name: N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-4-keto-4-[4-(2-pyrimidyl)piperazino]butyramide Formula: C18H25N7O2S MolecularWeight: 403.5018

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN=C(S1)NC(=O)CCC(=O)N2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

CC(C)(C)C1=NN=C(S1)NC(=O)CCC(=O)N2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C18H25N7O2S/c1-18(2,3)15-22-23-17(28-15)21-13(26)5-6-14(27)24-9-11-25(12-10-24)16-19-7-4-8-20-16/h4,7-8H,5-6,9-12H2,1-3H3,(H,21,23,26)