2-[10-methyl-6-[(3-oxidanylidene-1H-isoindol-2-yl)carbonyl]phenothiazin-4-yl]ethanenitrile

Systemtic Name: 2-[10-methyl-6-[(3-oxidanylidene-1H-isoindol-2-yl)carbonyl]phenothiazin-4-yl]ethanenitrile Openeye Name: 2-[10-methyl-6-(1-oxoisoindoline-2-carbonyl)phenothiazin-4-yl]acetonitrile CAS Name: 2-[10-methyl-6-[oxo-(3-oxo-1H-isoindol-2-yl)methyl]-4-phenothiazinyl]acetonitrile IUPAC Name: 2-[10-methyl-6-(3-oxo-1H-isoindole-2-carbonyl)phenothiazin-4-yl]acetonitrile Traditional Name: 2-[6-(1-ketoisoindoline-2-carbonyl)-10-methyl-phenothiazin-4-yl]acetonitrile Formula: C24H17N3O2S MolecularWeight: 411.47568

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC(=C2SC3=C(C=CC=C31)C(=O)N4CC5=CC=CC=C5C4=O)CC#N

Isomeric SMILES

CN1C2=CC=CC(=C2SC3=C(C=CC=C31)C(=O)N4CC5=CC=CC=C5C4=O)CC#N

InChI

InChI=1S/C24H17N3O2S/c1-26-19-10-4-7-15(12-13-25)21(19)30-22-18(9-5-11-20(22)26)24(29)27-14-16-6-2-3-8-17(16)23(27)28/h2-11H,12,14H2,1H3