N-[1-(2-methyl-1-pyrrolidin-1-yl-propan-2-yl)imidazol-4-yl]-2-[2-(4-phenyl-1,3-thiazol-2-yl)ethanoylamino]pentanamide

Systemtic Name: N-[1-(2-methyl-1-pyrrolidin-1-yl-propan-2-yl)imidazol-4-yl]-2-[2-(4-phenyl-1,3-thiazol-2-yl)ethanoylamino]pentanamide Openeye Name: N-[1-(1,1-dimethyl-2-pyrrolidin-1-yl-ethyl)imidazol-4-yl]-2-[[2-(4-phenylthiazol-2-yl)acetyl]amino]pentanamide CAS Name: N-[1-[2-methyl-1-(1-pyrrolidinyl)propan-2-yl]-4-imidazolyl]-2-[[1-oxo-2-(4-phenyl-2-thiazolyl)ethyl]amino]pentanamide IUPAC Name: N-[1-(2-methyl-1-pyrrolidin-1-ylpropan-2-yl)imidazol-4-yl]-2-[[2-(4-phenyl-1,3-thiazol-2-yl)acetyl]amino]pentanamide Traditional Name: N-[1-(1,1-dimethyl-2-pyrrolidino-ethyl)imidazol-4-yl]-2-[[2-(4-phenylthiazol-2-yl)acetyl]amino]valeramide Formula: C27H36N6O2S MolecularWeight: 508.67874

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)NC1=CN(C=N1)C(C)(C)CN2CCCC2)NC(=O)CC3=NC(=CS3)C4=CC=CC=C4

Isomeric SMILES

CCCC(C(=O)NC1=CN(C=N1)C(C)(C)CN2CCCC2)NC(=O)CC3=NC(=CS3)C4=CC=CC=C4

InChI

InChI=1S/C27H36N6O2S/c1-4-10-21(29-24(34)15-25-30-22(17-36-25)20-11-6-5-7-12-20)26(35)31-23-16-33(19-28-23)27(2,3)18-32-13-8-9-14-32/h5-7,11-12,16-17,19,21H,4,8-10,13-15,18H2,1-3H3,(H,29,34)(H,31,35)