N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxidanylidene-4-(4-pyrimidin-2-ylpiperazin-1-yl)butanamide

Systemtic Name: N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxidanylidene-4-(4-pyrimidin-2-ylpiperazin-1-yl)butanamide Openeye Name: N-(5-isobutyl-1,3,4-thiadiazol-2-yl)-4-oxo-4-(4-pyrimidin-2-ylpiperazin-1-yl)butanamide CAS Name: N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxo-4-[4-(2-pyrimidinyl)-1-piperazinyl]butanamide IUPAC Name: N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxo-4-(4-pyrimidin-2-ylpiperazin-1-yl)butanamide Traditional Name: N-(5-isobutyl-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)CC1=NN=C(S1)NC(=O)CCC(=O)N2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

CC(C)CC1=NN=C(S1)NC(=O)CCC(=O)N2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C18H25N7O2S/c1-13(2)12-15-22-23-18(28-15)21-14(26)4-5-16(27)24-8-10-25(11-9-24)17-19-6-3-7-20-17/h3,6-7,13H,4-5,8-12H2,1-2H3,(H,21,23,26)