tert-butyl N-[5-methyl-4-oxidanylidene-2-[4-(phenylsulfonyl)piperazin-1-yl]-3,1-benzoxazin-6-yl]carbamate

Systemtic Name: tert-butyl N-[5-methyl-4-oxidanylidene-2-[4-(phenylsulfonyl)piperazin-1-yl]-3,1-benzoxazin-6-yl]carbamate Openeye Name: tert-butyl N-[2-[4-(benzenesulfonyl)piperazin-1-yl]-5-methyl-4-oxo-3,1-benzoxazin-6-yl]carbamate CAS Name: N-[2-[4-(benzenesulfonyl)-1-piperazinyl]-5-methyl-4-oxo-3,1-benzoxazin-6-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[2-[4-(benzenesulfonyl)piperazin-1-yl]-5-methyl-4-oxo-3,1-benzoxazin-6-yl]carbamate Traditional Name: N-[2-(4-besylpiperazino)-4-keto-5-methyl-3,1-benzoxazin-6-yl]carbamic acid tert-butyl ester Formula: C24H28N4O6S MolecularWeight: 500.56732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1C(=O)OC(=N2)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4)NC(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(C=CC2=C1C(=O)OC(=N2)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4)NC(=O)OC(C)(C)C

InChI

InChI=1S/C24H28N4O6S/c1-16-18(26-23(30)34-24(2,3)4)10-11-19-20(16)21(29)33-22(25-19)27-12-14-28(15-13-27)35(31,32)17-8-6-5-7-9-17/h5-11H,12-15H2,1-4H3,(H,26,30)