2-(1-carbazol-9-yl-1-oxidanylidene-butan-2-yl)sulfanyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: 2-(1-carbazol-9-yl-1-oxidanylidene-butan-2-yl)sulfanyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-[1-(carbazole-9-carbonyl)propylsulfanyl]-5,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-[[1-(9-carbazolyl)-1-oxobutan-2-yl]thio]-5,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-(1-carbazol-9-yl-1-oxobutan-2-yl)sulfanyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-[1-(carbazole-9-carbonyl)propylthio]-5,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C26H23N3OS MolecularWeight: 425.54532

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N1C2=CC=CC=C2C3=CC=CC=C31)SC4=NC5=C(CCCC5)C=C4C#N

Isomeric SMILES

CCC(C(=O)N1C2=CC=CC=C2C3=CC=CC=C31)SC4=NC5=C(CCCC5)C=C4C#N

InChI

InChI=1S/C26H23N3OS/c1-2-24(31-25-18(16-27)15-17-9-3-6-12-21(17)28-25)26(30)29-22-13-7-4-10-19(22)20-11-5-8-14-23(20)29/h4-5,7-8,10-11,13-15,24H,2-3,6,9,12H2,1H3