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

Systemtic Name: 2-(3-oxidanylidene-3-phenothiazin-10-yl-propyl)sulfanyl-6-phenyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-(3-oxo-3-phenothiazin-10-yl-propyl)sulfanyl-6-phenyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-[[3-oxo-3-(10-phenothiazinyl)propyl]thio]-6-phenyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-(3-oxo-3-phenothiazin-10-ylpropyl)sulfanyl-6-phenyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-[(3-keto-3-phenothiazin-10-yl-propyl)thio]-6-phenyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C31H25N3OS2 MolecularWeight: 519.6797

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(CC1C3=CC=CC=C3)C=C(C(=N2)SCCC(=O)N4C5=CC=CC=C5SC6=CC=CC=C64)C#N

Isomeric SMILES

C1CC2=C(CC1C3=CC=CC=C3)C=C(C(=N2)SCCC(=O)N4C5=CC=CC=C5SC6=CC=CC=C64)C#N

InChI

InChI=1S/C31H25N3OS2/c32-20-24-19-23-18-22(21-8-2-1-3-9-21)14-15-25(23)33-31(24)36-17-16-30(35)34-26-10-4-6-12-28(26)37-29-13-7-5-11-27(29)34/h1-13,19,22H,14-18H2