2-azanyl-4-(3-ethylsulfanylthiophen-2-yl)-1-(2-fluorophenyl)-5-oxidanylidene-4,6,7,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: 2-azanyl-4-(3-ethylsulfanylthiophen-2-yl)-1-(2-fluorophenyl)-5-oxidanylidene-4,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-amino-4-(3-ethylsulfanyl-2-thienyl)-1-(2-fluorophenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-amino-4-[3-(ethylthio)-2-thiophenyl]-1-(2-fluorophenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-amino-4-(3-ethylsulfanylthiophen-2-yl)-1-(2-fluorophenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-amino-4-[3-(ethylthio)-2-thienyl]-1-(2-fluorophenyl)-5-keto-4,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C22H20FN3OS2 MolecularWeight: 425.542103

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=C(SC=C1)C2C(=C(N(C3=C2C(=O)CCC3)C4=CC=CC=C4F)N)C#N

Isomeric SMILES

CCSC1=C(SC=C1)C2C(=C(N(C3=C2C(=O)CCC3)C4=CC=CC=C4F)N)C#N

InChI

InChI=1S/C22H20FN3OS2/c1-2-28-18-10-11-29-21(18)19-13(12-24)22(25)26(15-7-4-3-6-14(15)23)16-8-5-9-17(27)20(16)19/h3-4,6-7,10-11,19H,2,5,8-9,25H2,1H3