2-(1-carbazol-9-yl-1-oxidanylidene-butan-2-yl)sulfanyl-6-propyl-pyridine-3-carbonitrile

Systemtic Name: 2-(1-carbazol-9-yl-1-oxidanylidene-butan-2-yl)sulfanyl-6-propyl-pyridine-3-carbonitrile Openeye Name: 2-[1-(carbazole-9-carbonyl)propylsulfanyl]-6-propyl-pyridine-3-carbonitrile CAS Name: 2-[[1-(9-carbazolyl)-1-oxobutan-2-yl]thio]-6-propyl-3-pyridinecarbonitrile IUPAC Name: 2-(1-carbazol-9-yl-1-oxobutan-2-yl)sulfanyl-6-propylpyridine-3-carbonitrile Traditional Name: 2-[1-(carbazole-9-carbonyl)propylthio]-6-propyl-nicotinonitrile Formula: C25H23N3OS MolecularWeight: 413.53462

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=C(C=C1)C#N)SC(CC)C(=O)N2C3=CC=CC=C3C4=CC=CC=C42

Isomeric SMILES

CCCC1=NC(=C(C=C1)C#N)SC(CC)C(=O)N2C3=CC=CC=C3C4=CC=CC=C42

InChI

InChI=1S/C25H23N3OS/c1-3-9-18-15-14-17(16-26)24(27-18)30-23(4-2)25(29)28-21-12-7-5-10-19(21)20-11-6-8-13-22(20)28/h5-8,10-15,23H,3-4,9H2,1-2H3