N-[3-[2-[(4-chloranyl-2-methoxy-5-methyl-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]sulfanylphenyl]-4a,10a-dihydrophenothiazine-10-carboxamide

Systemtic Name: N-[3-[2-[(4-chloranyl-2-methoxy-5-methyl-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]sulfanylphenyl]-4a,10a-dihydrophenothiazine-10-carboxamide Openeye Name: N-[3-[2-(4-chloro-2-methoxy-5-methyl-anilino)-2-oxo-1-phenyl-ethyl]sulfanylphenyl]-4a,10a-dihydrophenothiazine-10-carboxamide CAS Name: N-[3-[[2-(4-chloro-2-methoxy-5-methylanilino)-2-oxo-1-phenylethyl]thio]phenyl]-4a,10a-dihydrophenothiazine-10-carboxamide IUPAC Name: N-[3-[2-(4-chloro-2-methoxy-5-methylanilino)-2-oxo-1-phenylethyl]sulfanylphenyl]-4a,10a-dihydrophenothiazine-10-carboxamide Traditional Name: N-[3-[[2-(4-chloro-2-methoxy-5-methyl-anilino)-2-keto-1-phenyl-ethyl]thio]phenyl]-4a,10a-dihydrophenothiazine-10-carboxamide Formula: C35H30ClN3O3S2 MolecularWeight: 640.214

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)OC)NC(=O)C(C2=CC=CC=C2)SC3=CC=CC(=C3)NC(=O)N4C5C=CC=CC5SC6=CC=CC=C64

Isomeric SMILES

CC1=CC(=C(C=C1Cl)OC)NC(=O)C(C2=CC=CC=C2)SC3=CC=CC(=C3)NC(=O)N4C5C=CC=CC5SC6=CC=CC=C64

InChI

InChI=1S/C35H30ClN3O3S2/c1-22-19-27(30(42-2)21-26(22)36)38-34(40)33(23-11-4-3-5-12-23)43-25-14-10-13-24(20-25)37-35(41)39-28-15-6-8-17-31(28)44-32-18-9-7-16-29(32)39/h3-21,28,31,33H,1-2H3,(H,37,41)(H,38,40)