N-tert-butyl-2-[4-[2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]pyridin-3-yl]carbonylpiperazin-1-yl]ethanamide

Systemtic Name: N-tert-butyl-2-[4-[2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]pyridin-3-yl]carbonylpiperazin-1-yl]ethanamide Openeye Name: N-tert-butyl-2-[4-[2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]pyridine-3-carbonyl]piperazin-1-yl]acetamide CAS Name: N-tert-butyl-2-[4-[[2-[(3,5-dimethyl-4-isoxazolyl)methylthio]-3-pyridinyl]-oxomethyl]-1-piperazinyl]acetamide IUPAC Name: N-tert-butyl-2-[4-[2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]pyridine-3-carbonyl]piperazin-1-yl]acetamide Traditional Name: N-tert-butyl-2-[4-[2-[(3,5-dimethylisoxazol-4-yl)methylthio]nicotinoyl]piperazino]acetamide Formula: C22H31N5O3S MolecularWeight: 445.57824

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CSC2=C(C=CC=N2)C(=O)N3CCN(CC3)CC(=O)NC(C)(C)C

Isomeric SMILES

CC1=C(C(=NO1)C)CSC2=C(C=CC=N2)C(=O)N3CCN(CC3)CC(=O)NC(C)(C)C

InChI

InChI=1S/C22H31N5O3S/c1-15-18(16(2)30-25-15)14-31-20-17(7-6-8-23-20)21(29)27-11-9-26(10-12-27)13-19(28)24-22(3,4)5/h6-8H,9-14H2,1-5H3,(H,24,28)