2-azanyl-4-(2-ethylsulfanyl-5-methyl-furan-3-yl)-7,7-dimethyl-1-naphthalen-1-yl-5-oxidanylidene-6,8-dihydro-4H-quinoline-3-carbonitrile

Systemtic Name: 2-azanyl-4-(2-ethylsulfanyl-5-methyl-furan-3-yl)-7,7-dimethyl-1-naphthalen-1-yl-5-oxidanylidene-6,8-dihydro-4H-quinoline-3-carbonitrile Openeye Name: 2-amino-4-(2-ethylsulfanyl-5-methyl-3-furyl)-7,7-dimethyl-1-(1-naphthyl)-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile CAS Name: 2-amino-4-[2-(ethylthio)-5-methyl-3-furanyl]-7,7-dimethyl-1-(1-naphthalenyl)-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile IUPAC Name: 2-amino-4-(2-ethylsulfanyl-5-methylfuran-3-yl)-7,7-dimethyl-1-naphthalen-1-yl-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile Traditional Name: 2-amino-4-[2-(ethylthio)-5-methyl-3-furyl]-5-keto-7,7-dimethyl-1-(1-naphthyl)-6,8-dihydro-4H-quinoline-3-carbonitrile Formula: C29H29N3O2S MolecularWeight: 483.62446

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=C(C=C(O1)C)C2C(=C(N(C3=C2C(=O)CC(C3)(C)C)C4=CC=CC5=CC=CC=C54)N)C#N

Isomeric SMILES

CCSC1=C(C=C(O1)C)C2C(=C(N(C3=C2C(=O)CC(C3)(C)C)C4=CC=CC5=CC=CC=C54)N)C#N

InChI

InChI=1S/C29H29N3O2S/c1-5-35-28-20(13-17(2)34-28)25-21(16-30)27(31)32(23-14-29(3,4)15-24(33)26(23)25)22-12-8-10-18-9-6-7-11-19(18)22/h6-13,25H,5,14-15,31H2,1-4H3