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

Systemtic Name: 2-azanyl-1-(2-chloranylpyridin-3-yl)-4-(2-ethylsulfanyl-5-methyl-furan-3-yl)-5-oxidanylidene-4,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-amino-1-(2-chloro-3-pyridyl)-4-(2-ethylsulfanyl-5-methyl-3-furyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-amino-1-(2-chloro-3-pyridinyl)-4-[2-(ethylthio)-5-methyl-3-furanyl]-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-amino-1-(2-chloropyridin-3-yl)-4-(2-ethylsulfanyl-5-methylfuran-3-yl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-amino-1-(2-chloro-3-pyridyl)-4-[2-(ethylthio)-5-methyl-3-furyl]-5-keto-4,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C22H21ClN4O2S MolecularWeight: 440.94574

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H21ClN4O2S/c1-3-30-22-13(10-12(2)29-22)18-14(11-24)21(25)27(16-7-5-9-26-20(16)23)15-6-4-8-17(28)19(15)18/h5,7,9-10,18H,3-4,6,8,25H2,1-2H3