2-(1-carbazol-9-yl-1-oxidanylidene-butan-2-yl)sulfanyl-6-(4-methoxyphenyl)pyridine-3-carbonitrile

Systemtic Name: 2-(1-carbazol-9-yl-1-oxidanylidene-butan-2-yl)sulfanyl-6-(4-methoxyphenyl)pyridine-3-carbonitrile Openeye Name: 2-[1-(carbazole-9-carbonyl)propylsulfanyl]-6-(4-methoxyphenyl)pyridine-3-carbonitrile CAS Name: 2-[[1-(9-carbazolyl)-1-oxobutan-2-yl]thio]-6-(4-methoxyphenyl)-3-pyridinecarbonitrile IUPAC Name: 2-(1-carbazol-9-yl-1-oxobutan-2-yl)sulfanyl-6-(4-methoxyphenyl)pyridine-3-carbonitrile Traditional Name: 2-[1-(carbazole-9-carbonyl)propylthio]-6-(4-methoxyphenyl)nicotinonitrile Formula: C29H23N3O2S MolecularWeight: 477.57682

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N1C2=CC=CC=C2C3=CC=CC=C31)SC4=C(C=CC(=N4)C5=CC=C(C=C5)OC)C#N

Isomeric SMILES

CCC(C(=O)N1C2=CC=CC=C2C3=CC=CC=C31)SC4=C(C=CC(=N4)C5=CC=C(C=C5)OC)C#N

InChI

InChI=1S/C29H23N3O2S/c1-3-27(29(33)32-25-10-6-4-8-22(25)23-9-5-7-11-26(23)32)35-28-20(18-30)14-17-24(31-28)19-12-15-21(34-2)16-13-19/h4-17,27H,3H2,1-2H3