2-azanyl-6-[2-[(5-chloranylthiophen-2-yl)methyl-ethyl-amino]-2-oxidanylidene-ethyl]sulfanyl-5-cyano-N-phenyl-pyridine-3-carboxamide

Systemtic Name: 2-azanyl-6-[2-[(5-chloranylthiophen-2-yl)methyl-ethyl-amino]-2-oxidanylidene-ethyl]sulfanyl-5-cyano-N-phenyl-pyridine-3-carboxamide Openeye Name: 2-amino-6-[2-[(5-chloro-2-thienyl)methyl-ethyl-amino]-2-oxo-ethyl]sulfanyl-5-cyano-N-phenyl-pyridine-3-carboxamide CAS Name: 2-amino-6-[[2-[(5-chloro-2-thiophenyl)methyl-ethylamino]-2-oxoethyl]thio]-5-cyano-N-phenyl-3-pyridinecarboxamide IUPAC Name: 2-amino-6-[2-[(5-chlorothiophen-2-yl)methyl-ethylamino]-2-oxoethyl]sulfanyl-5-cyano-N-phenylpyridine-3-carboxamide Traditional Name: 2-amino-6-[[2-[(5-chloro-2-thienyl)methyl-ethyl-amino]-2-keto-ethyl]thio]-5-cyano-N-phenyl-nicotinamide Formula: C22H20ClN5O2S2 MolecularWeight: 486.0095

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=C(S1)Cl)C(=O)CSC2=NC(=C(C=C2C#N)C(=O)NC3=CC=CC=C3)N

Isomeric SMILES

CCN(CC1=CC=C(S1)Cl)C(=O)CSC2=NC(=C(C=C2C#N)C(=O)NC3=CC=CC=C3)N

InChI

InChI=1S/C22H20ClN5O2S2/c1-2-28(12-16-8-9-18(23)32-16)19(29)13-31-22-14(11-24)10-17(20(25)27-22)21(30)26-15-6-4-3-5-7-15/h3-10H,2,12-13H2,1H3,(H2,25,27)(H,26,30)