2-(1-oxidanylidene-1-phenothiazin-10-yl-butan-2-yl)sulfanyl-5,6,7,8,9,10-hexahydrocycloocta[b]pyridine-3-carbonitrile

Systemtic Name: 2-(1-oxidanylidene-1-phenothiazin-10-yl-butan-2-yl)sulfanyl-5,6,7,8,9,10-hexahydrocycloocta[b]pyridine-3-carbonitrile Openeye Name: 2-[1-(phenothiazine-10-carbonyl)propylsulfanyl]-5,6,7,8,9,10-hexahydrocycloocta[b]pyridine-3-carbonitrile CAS Name: 2-[[1-oxo-1-(10-phenothiazinyl)butan-2-yl]thio]-5,6,7,8,9,10-hexahydrocycloocta[b]pyridine-3-carbonitrile IUPAC Name: 2-(1-oxo-1-phenothiazin-10-ylbutan-2-yl)sulfanyl-5,6,7,8,9,10-hexahydrocycloocta[b]pyridine-3-carbonitrile Traditional Name: 2-[1-(phenothiazine-10-carbonyl)propylthio]-5,6,7,8,9,10-hexahydrocycloocta[b]pyridine-3-carbonitrile Formula: C28H27N3OS2 MolecularWeight: 485.66348

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N1C2=CC=CC=C2SC3=CC=CC=C31)SC4=NC5=C(CCCCCC5)C=C4C#N

Isomeric SMILES

CCC(C(=O)N1C2=CC=CC=C2SC3=CC=CC=C31)SC4=NC5=C(CCCCCC5)C=C4C#N

InChI

InChI=1S/C28H27N3OS2/c1-2-24(34-27-20(18-29)17-19-11-5-3-4-6-12-21(19)30-27)28(32)31-22-13-7-9-15-25(22)33-26-16-10-8-14-23(26)31/h7-10,13-17,24H,2-6,11-12H2,1H3