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

Systemtic Name: 2-(3-carbazol-9-yl-3-oxidanylidene-propyl)sulfanyl-6-(4-chlorophenyl)pyridine-3-carbonitrile Openeye Name: 2-(3-carbazol-9-yl-3-oxo-propyl)sulfanyl-6-(4-chlorophenyl)pyridine-3-carbonitrile CAS Name: 2-[[3-(9-carbazolyl)-3-oxopropyl]thio]-6-(4-chlorophenyl)-3-pyridinecarbonitrile IUPAC Name: 2-(3-carbazol-9-yl-3-oxopropyl)sulfanyl-6-(4-chlorophenyl)pyridine-3-carbonitrile Traditional Name: 2-[(3-carbazol-9-yl-3-keto-propyl)thio]-6-(4-chlorophenyl)nicotinonitrile Formula: C27H18ClN3OS MolecularWeight: 467.96932

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=CC=CC=C3N2C(=O)CCSC4=C(C=CC(=N4)C5=CC=C(C=C5)Cl)C#N

Isomeric SMILES

C1=CC=C2C(=C1)C3=CC=CC=C3N2C(=O)CCSC4=C(C=CC(=N4)C5=CC=C(C=C5)Cl)C#N

InChI

InChI=1S/C27H18ClN3OS/c28-20-12-9-18(10-13-20)23-14-11-19(17-29)27(30-23)33-16-15-26(32)31-24-7-3-1-5-21(24)22-6-2-4-8-25(22)31/h1-14H,15-16H2