2-[(3R)-3-cyano-3-(4-methyl-1,3-thiazol-2-yl)-2-oxidanylidene-propyl]sulfanylquinoline-4-carboxamide

Systemtic Name: 2-[(3R)-3-cyano-3-(4-methyl-1,3-thiazol-2-yl)-2-oxidanylidene-propyl]sulfanylquinoline-4-carboxamide Openeye Name: 2-[(3R)-3-cyano-3-(4-methylthiazol-2-yl)-2-oxo-propyl]sulfanylquinoline-4-carboxamide CAS Name: 2-[[(3R)-3-cyano-3-(4-methyl-2-thiazolyl)-2-oxopropyl]thio]-4-quinolinecarboxamide IUPAC Name: 2-[(3R)-3-cyano-3-(4-methyl-1,3-thiazol-2-yl)-2-oxopropyl]sulfanylquinoline-4-carboxamide Traditional Name: 2-[[(3R)-3-cyano-2-keto-3-(4-methylthiazol-2-yl)propyl]thio]cinchoninamide Formula: C18H14N4O2S2 MolecularWeight: 382.45936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)C(C#N)C(=O)CSC2=NC3=CC=CC=C3C(=C2)C(=O)N

Isomeric SMILES

CC1=CSC(=N1)[C@H](C#N)C(=O)CSC2=NC3=CC=CC=C3C(=C2)C(=O)N

InChI

InChI=1S/C18H14N4O2S2/c1-10-8-26-18(21-10)13(7-19)15(23)9-25-16-6-12(17(20)24)11-4-2-3-5-14(11)22-16/h2-6,8,13H,9H2,1H3,(H2,20,24)/t13-/m1/s1