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

Systemtic Name: tert-butyl N-[5-methyl-4-oxidanylidene-2-(4-thiophen-2-ylcarbonylpiperazin-1-yl)-3,1-benzoxazin-6-yl]carbamate Openeye Name: tert-butyl N-[5-methyl-4-oxo-2-[4-(thiophene-2-carbonyl)piperazin-1-yl]-3,1-benzoxazin-6-yl]carbamate CAS Name: N-[5-methyl-4-oxo-2-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]-3,1-benzoxazin-6-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[5-methyl-4-oxo-2-[4-(thiophene-2-carbonyl)piperazin-1-yl]-3,1-benzoxazin-6-yl]carbamate Traditional Name: N-[4-keto-5-methyl-2-[4-(2-thenoyl)piperazino]-3,1-benzoxazin-6-yl]carbamic acid tert-butyl ester Formula: C23H26N4O5S MolecularWeight: 470.54134

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1C(=O)OC(=N2)N3CCN(CC3)C(=O)C4=CC=CS4)NC(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(C=CC2=C1C(=O)OC(=N2)N3CCN(CC3)C(=O)C4=CC=CS4)NC(=O)OC(C)(C)C

InChI

InChI=1S/C23H26N4O5S/c1-14-15(25-22(30)32-23(2,3)4)7-8-16-18(14)20(29)31-21(24-16)27-11-9-26(10-12-27)19(28)17-6-5-13-33-17/h5-8,13H,9-12H2,1-4H3,(H,25,30)