N-[3-acetamido-4-[2-[cyano(cyclohexylidene)methyl]-1,3-thiazol-4-yl]phenyl]ethanamide

Systemtic Name: N-[3-acetamido-4-[2-[cyano(cyclohexylidene)methyl]-1,3-thiazol-4-yl]phenyl]ethanamide Openeye Name: N-[3-acetamido-4-[2-[cyano(cyclohexylidene)methyl]thiazol-4-yl]phenyl]acetamide CAS Name: N-[3-acetamido-4-[2-[cyano(cyclohexylidene)methyl]-4-thiazolyl]phenyl]acetamide IUPAC Name: N-[3-acetamido-4-[2-[cyano(cyclohexylidene)methyl]-1,3-thiazol-4-yl]phenyl]acetamide Traditional Name: N-[3-acetamido-4-[2-[cyano(cyclohexylidene)methyl]thiazol-4-yl]phenyl]acetamide Formula: C21H22N4O2S MolecularWeight: 394.48998

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1)C2=CSC(=N2)C(=C3CCCCC3)C#N)NC(=O)C

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1)C2=CSC(=N2)C(=C3CCCCC3)C#N)NC(=O)C

InChI

InChI=1S/C21H22N4O2S/c1-13(26)23-16-8-9-17(19(10-16)24-14(2)27)20-12-28-21(25-20)18(11-22)15-6-4-3-5-7-15/h8-10,12H,3-7H2,1-2H3,(H,23,26)(H,24,27)