2-[4-(4-fluorophenyl)-4-oxidanylidene-butyl]sulfanyl-6-methyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: 2-[4-(4-fluorophenyl)-4-oxidanylidene-butyl]sulfanyl-6-methyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-[4-(4-fluorophenyl)-4-oxo-butyl]sulfanyl-6-methyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-[[4-(4-fluorophenyl)-4-oxobutyl]thio]-6-methyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-[4-(4-fluorophenyl)-4-oxobutyl]sulfanyl-6-methyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-[[4-(4-fluorophenyl)-4-keto-butyl]thio]-6-methyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C21H21FN2OS MolecularWeight: 368.467643

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C=C(C(=N2)SCCCC(=O)C3=CC=C(C=C3)F)C#N

Isomeric SMILES

CC1CCC2=C(C1)C=C(C(=N2)SCCCC(=O)C3=CC=C(C=C3)F)C#N

InChI

InChI=1S/C21H21FN2OS/c1-14-4-9-19-16(11-14)12-17(13-23)21(24-19)26-10-2-3-20(25)15-5-7-18(22)8-6-15/h5-8,12,14H,2-4,9-11H2,1H3