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

Systemtic Name: N-[3-[2-[(4-chloranyl-2-methoxy-5-methyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanylphenyl]-4a,10a-dihydrophenothiazine-10-carboxamide Openeye Name: N-[3-[2-(4-chloro-2-methoxy-5-methyl-anilino)-2-oxo-ethyl]sulfanylphenyl]-4a,10a-dihydrophenothiazine-10-carboxamide CAS Name: N-[3-[[2-(4-chloro-2-methoxy-5-methylanilino)-2-oxoethyl]thio]phenyl]-4a,10a-dihydrophenothiazine-10-carboxamide IUPAC Name: N-[3-[2-(4-chloro-2-methoxy-5-methylanilino)-2-oxoethyl]sulfanylphenyl]-4a,10a-dihydrophenothiazine-10-carboxamide Traditional Name: N-[3-[[2-(4-chloro-2-methoxy-5-methyl-anilino)-2-keto-ethyl]thio]phenyl]-4a,10a-dihydrophenothiazine-10-carboxamide Formula: C29H26ClN3O3S2 MolecularWeight: 564.11804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)OC)NC(=O)CSC2=CC=CC(=C2)NC(=O)N3C4C=CC=CC4SC5=CC=CC=C53

Isomeric SMILES

CC1=CC(=C(C=C1Cl)OC)NC(=O)CSC2=CC=CC(=C2)NC(=O)N3C4C=CC=CC4SC5=CC=CC=C53

InChI

InChI=1S/C29H26ClN3O3S2/c1-18-14-22(25(36-2)16-21(18)30)32-28(34)17-37-20-9-7-8-19(15-20)31-29(35)33-23-10-3-5-12-26(23)38-27-13-6-4-11-24(27)33/h3-16,23,26H,17H2,1-2H3,(H,31,35)(H,32,34)