ethyl 2-[2-[3-(6-azanyl-3,5-dicyano-4-phenyl-pyridin-2-yl)sulfanylpropanoylamino]-1,3-thiazol-4-yl]ethanoate

Systemtic Name: ethyl 2-[2-[3-(6-azanyl-3,5-dicyano-4-phenyl-pyridin-2-yl)sulfanylpropanoylamino]-1,3-thiazol-4-yl]ethanoate Openeye Name: ethyl 2-[2-[3-[(6-amino-3,5-dicyano-4-phenyl-2-pyridyl)sulfanyl]propanoylamino]thiazol-4-yl]acetate CAS Name: 2-[2-[[3-[(6-amino-3,5-dicyano-4-phenyl-2-pyridinyl)thio]-1-oxopropyl]amino]-4-thiazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[3-(6-amino-3,5-dicyano-4-phenylpyridin-2-yl)sulfanylpropanoylamino]-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-[3-[(6-amino-3,5-dicyano-4-phenyl-2-pyridyl)thio]propanoylamino]thiazol-4-yl]acetic acid ethyl ester Formula: C23H20N6O3S2 MolecularWeight: 492.5733

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CSC(=N1)NC(=O)CCSC2=C(C(=C(C(=N2)N)C#N)C3=CC=CC=C3)C#N

Isomeric SMILES

CCOC(=O)CC1=CSC(=N1)NC(=O)CCSC2=C(C(=C(C(=N2)N)C#N)C3=CC=CC=C3)C#N

InChI

InChI=1S/C23H20N6O3S2/c1-2-32-19(31)10-15-13-34-23(27-15)28-18(30)8-9-33-22-17(12-25)20(14-6-4-3-5-7-14)16(11-24)21(26)29-22/h3-7,13H,2,8-10H2,1H3,(H2,26,29)(H,27,28,30)