2-azanyl-5-cyano-6-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]sulfanyl-N-phenyl-pyridine-3-carboxamide

Systemtic Name: 2-azanyl-5-cyano-6-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]sulfanyl-N-phenyl-pyridine-3-carboxamide Openeye Name: 2-amino-5-cyano-6-[2-(cyclopropylamino)-2-oxo-ethyl]sulfanyl-N-phenyl-pyridine-3-carboxamide CAS Name: 2-amino-5-cyano-6-[[2-(cyclopropylamino)-2-oxoethyl]thio]-N-phenyl-3-pyridinecarboxamide IUPAC Name: 2-amino-5-cyano-6-[2-(cyclopropylamino)-2-oxoethyl]sulfanyl-N-phenylpyridine-3-carboxamide Traditional Name: 2-amino-5-cyano-6-[[2-(cyclopropylamino)-2-keto-ethyl]thio]-N-phenyl-nicotinamide Formula: C18H17N5O2S MolecularWeight: 367.42488

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)CSC2=NC(=C(C=C2C#N)C(=O)NC3=CC=CC=C3)N

Isomeric SMILES

C1CC1NC(=O)CSC2=NC(=C(C=C2C#N)C(=O)NC3=CC=CC=C3)N

InChI

InChI=1S/C18H17N5O2S/c19-9-11-8-14(17(25)22-12-4-2-1-3-5-12)16(20)23-18(11)26-10-15(24)21-13-6-7-13/h1-5,8,13H,6-7,10H2,(H2,20,23)(H,21,24)(H,22,25)