3-methyl-N-[1-(4-methylsulfonylpiperazin-1-yl)carbonyl-2-pyridin-2-yl-azetidin-3-yl]-N-phenyl-butanamide

Systemtic Name: 3-methyl-N-[1-(4-methylsulfonylpiperazin-1-yl)carbonyl-2-pyridin-2-yl-azetidin-3-yl]-N-phenyl-butanamide Openeye Name: 3-methyl-N-[1-(4-methylsulfonylpiperazine-1-carbonyl)-2-(2-pyridyl)azetidin-3-yl]-N-phenyl-butanamide CAS Name: 3-methyl-N-[1-[(4-methylsulfonyl-1-piperazinyl)-oxomethyl]-2-(2-pyridinyl)-3-azetidinyl]-N-phenylbutanamide IUPAC Name: 3-methyl-N-[1-(4-methylsulfonylpiperazine-1-carbonyl)-2-pyridin-2-ylazetidin-3-yl]-N-phenylbutanamide Traditional Name: N-[1-(4-mesylpiperazine-1-carbonyl)-2-(2-pyridyl)azetidin-3-yl]-3-methyl-N-phenyl-butyramide Formula: C25H33N5O4S MolecularWeight: 499.62562

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N(C1CN(C1C2=CC=CC=N2)C(=O)N3CCN(CC3)S(=O)(=O)C)C4=CC=CC=C4

Isomeric SMILES

CC(C)CC(=O)N(C1CN(C1C2=CC=CC=N2)C(=O)N3CCN(CC3)S(=O)(=O)C)C4=CC=CC=C4

InChI

InChI=1S/C25H33N5O4S/c1-19(2)17-23(31)30(20-9-5-4-6-10-20)22-18-29(24(22)21-11-7-8-12-26-21)25(32)27-13-15-28(16-14-27)35(3,33)34/h4-12,19,22,24H,13-18H2,1-3H3