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

Systemtic Name: 2-(1-oxidanylidene-1-phenothiazin-10-yl-butan-2-yl)sulfanyl-6-phenyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-[1-(phenothiazine-10-carbonyl)propylsulfanyl]-6-phenyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-[[1-oxo-1-(10-phenothiazinyl)butan-2-yl]thio]-6-phenyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-(1-oxo-1-phenothiazin-10-ylbutan-2-yl)sulfanyl-6-phenyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-[1-(phenothiazine-10-carbonyl)propylthio]-6-phenyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C32H27N3OS2 MolecularWeight: 533.70628

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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)C6=CC=CC=C6)C=C4C#N

Isomeric SMILES

CCC(C(=O)N1C2=CC=CC=C2SC3=CC=CC=C31)SC4=NC5=C(CC(CC5)C6=CC=CC=C6)C=C4C#N

InChI

InChI=1S/C32H27N3OS2/c1-2-28(32(36)35-26-12-6-8-14-29(26)37-30-15-9-7-13-27(30)35)38-31-24(20-33)19-23-18-22(16-17-25(23)34-31)21-10-4-3-5-11-21/h3-15,19,22,28H,2,16-18H2,1H3