2-[4-(7-chloranyl-2-oxidanylidene-4H-3,1-benzoxazin-1-yl)piperidin-1-yl]-N-dibenzothiophen-2-yl-ethanamide

Systemtic Name: 2-[4-(7-chloranyl-2-oxidanylidene-4H-3,1-benzoxazin-1-yl)piperidin-1-yl]-N-dibenzothiophen-2-yl-ethanamide Openeye Name: 2-[4-(7-chloro-2-oxo-4H-3,1-benzoxazin-1-yl)-1-piperidyl]-N-dibenzothiophen-2-yl-acetamide CAS Name: 2-[4-(7-chloro-2-oxo-4H-3,1-benzoxazin-1-yl)-1-piperidinyl]-N-(2-dibenzothiophenyl)acetamide IUPAC Name: 2-[4-(7-chloro-2-oxo-4H-3,1-benzoxazin-1-yl)piperidin-1-yl]-N-dibenzothiophen-2-ylacetamide Traditional Name: 2-[4-(7-chloro-2-keto-4H-3,1-benzoxazin-1-yl)piperidino]-N-dibenzothiophen-2-yl-acetamide Formula: C27H24ClN3O3S MolecularWeight: 506.01576

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C3=C(COC2=O)C=CC(=C3)Cl)CC(=O)NC4=CC5=C(C=C4)SC6=CC=CC=C65

Isomeric SMILES

C1CN(CCC1N2C3=C(COC2=O)C=CC(=C3)Cl)CC(=O)NC4=CC5=C(C=C4)SC6=CC=CC=C65

InChI

InChI=1S/C27H24ClN3O3S/c28-18-6-5-17-16-34-27(33)31(23(17)13-18)20-9-11-30(12-10-20)15-26(32)29-19-7-8-25-22(14-19)21-3-1-2-4-24(21)35-25/h1-8,13-14,20H,9-12,15-16H2,(H,29,32)