2-azanyl-4-(4-methylphenyl)-6-(1-oxidanylidene-1-phenothiazin-10-yl-butan-2-yl)sulfanyl-pyridine-3,5-dicarbonitrile

Systemtic Name: 2-azanyl-4-(4-methylphenyl)-6-(1-oxidanylidene-1-phenothiazin-10-yl-butan-2-yl)sulfanyl-pyridine-3,5-dicarbonitrile Openeye Name: 2-amino-6-[1-(phenothiazine-10-carbonyl)propylsulfanyl]-4-(p-tolyl)pyridine-3,5-dicarbonitrile CAS Name: 2-amino-4-(4-methylphenyl)-6-[[1-oxo-1-(10-phenothiazinyl)butan-2-yl]thio]pyridine-3,5-dicarbonitrile IUPAC Name: 2-amino-4-(4-methylphenyl)-6-(1-oxo-1-phenothiazin-10-ylbutan-2-yl)sulfanylpyridine-3,5-dicarbonitrile Traditional Name: 2-amino-6-[1-(phenothiazine-10-carbonyl)propylthio]-4-(p-tolyl)dinicotinonitrile Formula: C30H23N5OS2 MolecularWeight: 533.66652

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N1C2=CC=CC=C2SC3=CC=CC=C31)SC4=C(C(=C(C(=N4)N)C#N)C5=CC=C(C=C5)C)C#N

Isomeric SMILES

CCC(C(=O)N1C2=CC=CC=C2SC3=CC=CC=C31)SC4=C(C(=C(C(=N4)N)C#N)C5=CC=C(C=C5)C)C#N

InChI

InChI=1S/C30H23N5OS2/c1-3-24(30(36)35-22-8-4-6-10-25(22)37-26-11-7-5-9-23(26)35)38-29-21(17-32)27(20(16-31)28(33)34-29)19-14-12-18(2)13-15-19/h4-15,24H,3H2,1-2H3,(H2,33,34)