(phenylmethyl) N-[1-[2-azanyl-3-oxidanylidene-1-(phenylsulfonyl)piperidin-2-yl]-4-methyl-1-oxidanylidene-pentan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[1-[2-azanyl-3-oxidanylidene-1-(phenylsulfonyl)piperidin-2-yl]-4-methyl-1-oxidanylidene-pentan-2-yl]carbamate Openeye Name: benzyl N-[1-[2-amino-1-(benzenesulfonyl)-3-oxo-piperidine-2-carbonyl]-3-methyl-butyl]carbamate CAS Name: N-[1-[2-amino-1-(benzenesulfonyl)-3-oxo-2-piperidinyl]-4-methyl-1-oxopentan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[1-[2-amino-1-(benzenesulfonyl)-3-oxopiperidin-2-yl]-4-methyl-1-oxopentan-2-yl]carbamate Traditional Name: N-[1-(2-amino-1-besyl-3-keto-pipecoloyl)-3-methyl-butyl]carbamic acid benzyl ester Formula: C25H31N3O6S MolecularWeight: 501.59514

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)C1(C(=O)CCCN1S(=O)(=O)C2=CC=CC=C2)N)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)CC(C(=O)C1(C(=O)CCCN1S(=O)(=O)C2=CC=CC=C2)N)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C25H31N3O6S/c1-18(2)16-21(27-24(31)34-17-19-10-5-3-6-11-19)23(30)25(26)22(29)14-9-15-28(25)35(32,33)20-12-7-4-8-13-20/h3-8,10-13,18,21H,9,14-17,26H2,1-2H3,(H,27,31)