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

Systemtic Name: 2-(3-carbazol-9-yl-3-oxidanylidene-propyl)sulfanyl-6-(4-methoxyphenyl)pyridine-3-carbonitrile Openeye Name: 2-(3-carbazol-9-yl-3-oxo-propyl)sulfanyl-6-(4-methoxyphenyl)pyridine-3-carbonitrile CAS Name: 2-[[3-(9-carbazolyl)-3-oxopropyl]thio]-6-(4-methoxyphenyl)-3-pyridinecarbonitrile IUPAC Name: 2-(3-carbazol-9-yl-3-oxopropyl)sulfanyl-6-(4-methoxyphenyl)pyridine-3-carbonitrile Traditional Name: 2-[(3-carbazol-9-yl-3-keto-propyl)thio]-6-(4-methoxyphenyl)nicotinonitrile Formula: C28H21N3O2S MolecularWeight: 463.55024

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC(=C(C=C2)C#N)SCCC(=O)N3C4=CC=CC=C4C5=CC=CC=C53

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC(=C(C=C2)C#N)SCCC(=O)N3C4=CC=CC=C4C5=CC=CC=C53

InChI

InChI=1S/C28H21N3O2S/c1-33-21-13-10-19(11-14-21)24-15-12-20(18-29)28(30-24)34-17-16-27(32)31-25-8-4-2-6-22(25)23-7-3-5-9-26(23)31/h2-15H,16-17H2,1H3