tert-butyl N-[[4-[(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)carbamoyl]phenyl]methyl]carbamate

Systemtic Name: tert-butyl N-[[4-[(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)carbamoyl]phenyl]methyl]carbamate Openeye Name: tert-butyl N-[[4-[[2-methyl-5-(1-piperidylsulfonyl)phenyl]carbamoyl]phenyl]methyl]carbamate CAS Name: N-[[4-[[2-methyl-5-(1-piperidinylsulfonyl)anilino]-oxomethyl]phenyl]methyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[[4-[(2-methyl-5-piperidin-1-ylsulfonylphenyl)carbamoyl]phenyl]methyl]carbamate Traditional Name: N-[4-[(2-methyl-5-piperidinosulfonyl-phenyl)carbamoyl]benzyl]carbamic acid tert-butyl ester Formula: C25H33N3O5S MolecularWeight: 487.61162

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3=CC=C(C=C3)CNC(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3=CC=C(C=C3)CNC(=O)OC(C)(C)C

InChI

InChI=1S/C25H33N3O5S/c1-18-8-13-21(34(31,32)28-14-6-5-7-15-28)16-22(18)27-23(29)20-11-9-19(10-12-20)17-26-24(30)33-25(2,3)4/h8-13,16H,5-7,14-15,17H2,1-4H3,(H,26,30)(H,27,29)