6-methyl-2-(1-oxidanylidene-1-phenothiazin-10-yl-butan-2-yl)sulfanyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: 6-methyl-2-(1-oxidanylidene-1-phenothiazin-10-yl-butan-2-yl)sulfanyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 6-methyl-2-[1-(phenothiazine-10-carbonyl)propylsulfanyl]-5,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 6-methyl-2-[[1-oxo-1-(10-phenothiazinyl)butan-2-yl]thio]-5,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 6-methyl-2-(1-oxo-1-phenothiazin-10-ylbutan-2-yl)sulfanyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 6-methyl-2-[1-(phenothiazine-10-carbonyl)propylthio]-5,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C27H25N3OS2 MolecularWeight: 471.6369

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N1C2=CC=CC=C2SC3=CC=CC=C31)SC4=NC5=C(CC(CC5)C)C=C4C#N

Isomeric SMILES

CCC(C(=O)N1C2=CC=CC=C2SC3=CC=CC=C31)SC4=NC5=C(CC(CC5)C)C=C4C#N

InChI

InChI=1S/C27H25N3OS2/c1-3-23(33-26-19(16-28)15-18-14-17(2)12-13-20(18)29-26)27(31)30-21-8-4-6-10-24(21)32-25-11-7-5-9-22(25)30/h4-11,15,17,23H,3,12-14H2,1-2H3