methyl N-[[3-[[4-(oxan-4-yl)-2-oxidanylidene-piperazin-1-yl]methyl]-2-phenyl-quinolin-4-yl]carbonylamino]-N-phenyl-carbamate

Systemtic Name: methyl N-[[3-[[4-(oxan-4-yl)-2-oxidanylidene-piperazin-1-yl]methyl]-2-phenyl-quinolin-4-yl]carbonylamino]-N-phenyl-carbamate Openeye Name: methyl N-[[3-[(2-oxo-4-tetrahydropyran-4-yl-piperazin-1-yl)methyl]-2-phenyl-quinoline-4-carbonyl]amino]-N-phenyl-carbamate CAS Name: N-[[[3-[[4-(4-oxanyl)-2-oxo-1-piperazinyl]methyl]-2-phenyl-4-quinolinyl]-oxomethyl]amino]-N-phenylcarbamic acid methyl ester IUPAC Name: methyl N-[[3-[[4-(oxan-4-yl)-2-oxopiperazin-1-yl]methyl]-2-phenylquinoline-4-carbonyl]amino]-N-phenylcarbamate Traditional Name: N-[[3-[(2-keto-4-tetrahydropyran-4-yl-piperazino)methyl]-2-phenyl-quinoline-4-carbonyl]amino]-N-phenyl-carbamic acid methyl ester Formula: C34H35N5O5 MolecularWeight: 593.6722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N(C1=CC=CC=C1)NC(=O)C2=C(C(=NC3=CC=CC=C32)C4=CC=CC=C4)CN5CCN(CC5=O)C6CCOCC6

Isomeric SMILES

COC(=O)N(C1=CC=CC=C1)NC(=O)C2=C(C(=NC3=CC=CC=C32)C4=CC=CC=C4)CN5CCN(CC5=O)C6CCOCC6

InChI

InChI=1S/C34H35N5O5/c1-43-34(42)39(26-12-6-3-7-13-26)36-33(41)31-27-14-8-9-15-29(27)35-32(24-10-4-2-5-11-24)28(31)22-38-19-18-37(23-30(38)40)25-16-20-44-21-17-25/h2-15,25H,16-23H2,1H3,(H,36,41)