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

Systemtic Name: 2-azanyl-6-(1-oxidanylidene-1-phenothiazin-10-yl-butan-2-yl)sulfanyl-4-propan-2-yl-pyridine-3,5-dicarbonitrile Openeye Name: 2-amino-4-isopropyl-6-[1-(phenothiazine-10-carbonyl)propylsulfanyl]pyridine-3,5-dicarbonitrile CAS Name: 2-amino-6-[[1-oxo-1-(10-phenothiazinyl)butan-2-yl]thio]-4-propan-2-ylpyridine-3,5-dicarbonitrile IUPAC Name: 2-amino-6-(1-oxo-1-phenothiazin-10-ylbutan-2-yl)sulfanyl-4-propan-2-ylpyridine-3,5-dicarbonitrile Traditional Name: 2-amino-4-isopropyl-6-[1-(phenothiazine-10-carbonyl)propylthio]dinicotinonitrile Formula: C26H23N5OS2 MolecularWeight: 485.62372

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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)C(C)C)C#N

Isomeric SMILES

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

InChI

InChI=1S/C26H23N5OS2/c1-4-20(34-25-17(14-28)23(15(2)3)16(13-27)24(29)30-25)26(32)31-18-9-5-7-11-21(18)33-22-12-8-6-10-19(22)31/h5-12,15,20H,4H2,1-3H3,(H2,29,30)