2-[3-oxidanylidene-3-(1,2,3,4-tetrahydrocarbazol-9-yl)propyl]sulfanyl-6-propyl-pyridine-3-carbonitrile

Systemtic Name: 2-[3-oxidanylidene-3-(1,2,3,4-tetrahydrocarbazol-9-yl)propyl]sulfanyl-6-propyl-pyridine-3-carbonitrile Openeye Name: 2-[3-oxo-3-(1,2,3,4-tetrahydrocarbazol-9-yl)propyl]sulfanyl-6-propyl-pyridine-3-carbonitrile CAS Name: 2-[[3-oxo-3-(1,2,3,4-tetrahydrocarbazol-9-yl)propyl]thio]-6-propyl-3-pyridinecarbonitrile IUPAC Name: 2-[3-oxo-3-(1,2,3,4-tetrahydrocarbazol-9-yl)propyl]sulfanyl-6-propylpyridine-3-carbonitrile Traditional Name: 2-[[3-keto-3-(1,2,3,4-tetrahydrocarbazol-9-yl)propyl]thio]-6-propyl-nicotinonitrile Formula: C24H25N3OS MolecularWeight: 403.5398

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=C(C=C1)C#N)SCCC(=O)N2C3=C(CCCC3)C4=CC=CC=C42

Isomeric SMILES

CCCC1=NC(=C(C=C1)C#N)SCCC(=O)N2C3=C(CCCC3)C4=CC=CC=C42

InChI

InChI=1S/C24H25N3OS/c1-2-7-18-13-12-17(16-25)24(26-18)29-15-14-23(28)27-21-10-5-3-8-19(21)20-9-4-6-11-22(20)27/h3,5,8,10,12-13H,2,4,6-7,9,11,14-15H2,1H3