N-[3-(1-oxidanylidene-1-phenylazanyl-butan-2-yl)sulfanylphenyl]-4a,10a-dihydrophenothiazine-10-carboxamide

Systemtic Name: N-[3-(1-oxidanylidene-1-phenylazanyl-butan-2-yl)sulfanylphenyl]-4a,10a-dihydrophenothiazine-10-carboxamide Openeye Name: N-[3-[1-(phenylcarbamoyl)propylsulfanyl]phenyl]-4a,10a-dihydrophenothiazine-10-carboxamide CAS Name: N-[3-[(1-anilino-1-oxobutan-2-yl)thio]phenyl]-4a,10a-dihydrophenothiazine-10-carboxamide IUPAC Name: N-[3-(1-anilino-1-oxobutan-2-yl)sulfanylphenyl]-4a,10a-dihydrophenothiazine-10-carboxamide Traditional Name: N-[3-[1-(phenylcarbamoyl)propylthio]phenyl]-4a,10a-dihydrophenothiazine-10-carboxamide Formula: C29H27N3O2S2 MolecularWeight: 513.67358

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC=C1)SC2=CC=CC(=C2)NC(=O)N3C4C=CC=CC4SC5=CC=CC=C53

Isomeric SMILES

CCC(C(=O)NC1=CC=CC=C1)SC2=CC=CC(=C2)NC(=O)N3C4C=CC=CC4SC5=CC=CC=C53

InChI

InChI=1S/C29H27N3O2S2/c1-2-25(28(33)30-20-11-4-3-5-12-20)35-22-14-10-13-21(19-22)31-29(34)32-23-15-6-8-17-26(23)36-27-18-9-7-16-24(27)32/h3-19,23,25-26H,2H2,1H3,(H,30,33)(H,31,34)