2-azanyl-4-(2-ethylsulfanyl-5-methyl-furan-3-yl)-1-(4-iodophenyl)-5-oxidanylidene-4,6,7,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: 2-azanyl-4-(2-ethylsulfanyl-5-methyl-furan-3-yl)-1-(4-iodophenyl)-5-oxidanylidene-4,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-amino-4-(2-ethylsulfanyl-5-methyl-3-furyl)-1-(4-iodophenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-amino-4-[2-(ethylthio)-5-methyl-3-furanyl]-1-(4-iodophenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-amino-4-(2-ethylsulfanyl-5-methylfuran-3-yl)-1-(4-iodophenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-amino-4-[2-(ethylthio)-5-methyl-3-furyl]-1-(4-iodophenyl)-5-keto-4,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C23H22IN3O2S MolecularWeight: 531.40915

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=C(C=C(O1)C)C2C(=C(N(C3=C2C(=O)CCC3)C4=CC=C(C=C4)I)N)C#N

Isomeric SMILES

CCSC1=C(C=C(O1)C)C2C(=C(N(C3=C2C(=O)CCC3)C4=CC=C(C=C4)I)N)C#N

InChI

InChI=1S/C23H22IN3O2S/c1-3-30-23-16(11-13(2)29-23)20-17(12-25)22(26)27(15-9-7-14(24)8-10-15)18-5-4-6-19(28)21(18)20/h7-11,20H,3-6,26H2,1-2H3