N-[3-[2-[(2-bromophenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]sulfanylphenyl]-4a,10a-dihydrophenothiazine-10-carboxamide

Systemtic Name: N-[3-[2-[(2-bromophenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]sulfanylphenyl]-4a,10a-dihydrophenothiazine-10-carboxamide Openeye Name: N-[3-[2-(2-bromoanilino)-2-oxo-1-phenyl-ethyl]sulfanylphenyl]-4a,10a-dihydrophenothiazine-10-carboxamide CAS Name: N-[3-[[2-(2-bromoanilino)-2-oxo-1-phenylethyl]thio]phenyl]-4a,10a-dihydrophenothiazine-10-carboxamide IUPAC Name: N-[3-[2-(2-bromoanilino)-2-oxo-1-phenylethyl]sulfanylphenyl]-4a,10a-dihydrophenothiazine-10-carboxamide Traditional Name: N-[3-[[2-(2-bromoanilino)-2-keto-1-phenyl-ethyl]thio]phenyl]-4a,10a-dihydrophenothiazine-10-carboxamide Formula: C33H26BrN3O2S2 MolecularWeight: 640.61244

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)NC2=CC=CC=C2Br)SC3=CC=CC(=C3)NC(=O)N4C5C=CC=CC5SC6=CC=CC=C64

Isomeric SMILES

C1=CC=C(C=C1)C(C(=O)NC2=CC=CC=C2Br)SC3=CC=CC(=C3)NC(=O)N4C5C=CC=CC5SC6=CC=CC=C64

InChI

InChI=1S/C33H26BrN3O2S2/c34-25-15-4-5-16-26(25)36-32(38)31(22-11-2-1-3-12-22)40-24-14-10-13-23(21-24)35-33(39)37-27-17-6-8-19-29(27)41-30-20-9-7-18-28(30)37/h1-21,27,29,31H,(H,35,39)(H,36,38)