2-azanyl-4-[5-[(4-fluorophenyl)sulfanylmethyl]-2,4-dimethyl-phenyl]-7,7-dimethyl-1-naphthalen-1-yl-5-oxidanylidene-6,8-dihydro-4H-quinoline-3-carbonitrile

Systemtic Name: 2-azanyl-4-[5-[(4-fluorophenyl)sulfanylmethyl]-2,4-dimethyl-phenyl]-7,7-dimethyl-1-naphthalen-1-yl-5-oxidanylidene-6,8-dihydro-4H-quinoline-3-carbonitrile Openeye Name: 2-amino-4-[5-[(4-fluorophenyl)sulfanylmethyl]-2,4-dimethyl-phenyl]-7,7-dimethyl-1-(1-naphthyl)-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile CAS Name: 2-amino-4-[5-[[(4-fluorophenyl)thio]methyl]-2,4-dimethylphenyl]-7,7-dimethyl-1-(1-naphthalenyl)-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile IUPAC Name: 2-amino-4-[5-[(4-fluorophenyl)sulfanylmethyl]-2,4-dimethylphenyl]-7,7-dimethyl-1-naphthalen-1-yl-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile Traditional Name: 2-amino-4-[5-[[(4-fluorophenyl)thio]methyl]-2,4-dimethyl-phenyl]-5-keto-7,7-dimethyl-1-(1-naphthyl)-6,8-dihydro-4H-quinoline-3-carbonitrile Formula: C37H34FN3OS MolecularWeight: 587.748763

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C2C(=C(N(C3=C2C(=O)CC(C3)(C)C)C4=CC=CC5=CC=CC=C54)N)C#N)CSC6=CC=C(C=C6)F)C

Isomeric SMILES

CC1=CC(=C(C=C1C2C(=C(N(C3=C2C(=O)CC(C3)(C)C)C4=CC=CC5=CC=CC=C54)N)C#N)CSC6=CC=C(C=C6)F)C

InChI

InChI=1S/C37H34FN3OS/c1-22-16-23(2)29(17-25(22)21-43-27-14-12-26(38)13-15-27)34-30(20-39)36(40)41(32-18-37(3,4)19-33(42)35(32)34)31-11-7-9-24-8-5-6-10-28(24)31/h5-17,34H,18-19,21,40H2,1-4H3