2-[(4-butyl-5-methyl-1H-imidazol-2-yl)sulfanyl]-N-[3-cyano-4-methyl-5-(phenylmethyl)-1H-pyrrol-2-yl]ethanamide

Systemtic Name: 2-[(4-butyl-5-methyl-1H-imidazol-2-yl)sulfanyl]-N-[3-cyano-4-methyl-5-(phenylmethyl)-1H-pyrrol-2-yl]ethanamide Openeye Name: N-(5-benzyl-3-cyano-4-methyl-1H-pyrrol-2-yl)-2-[(4-butyl-5-methyl-1H-imidazol-2-yl)sulfanyl]acetamide CAS Name: 2-[(4-butyl-5-methyl-1H-imidazol-2-yl)thio]-N-[3-cyano-4-methyl-5-(phenylmethyl)-1H-pyrrol-2-yl]acetamide IUPAC Name: N-(5-benzyl-3-cyano-4-methyl-1H-pyrrol-2-yl)-2-[(4-butyl-5-methyl-1H-imidazol-2-yl)sulfanyl]acetamide Traditional Name: N-(5-benzyl-3-cyano-4-methyl-1H-pyrrol-2-yl)-2-[(4-butyl-5-methyl-1H-imidazol-2-yl)thio]acetamide Formula: C23H27N5OS MolecularWeight: 421.55838

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(NC(=N1)SCC(=O)NC2=C(C(=C(N2)CC3=CC=CC=C3)C)C#N)C

Isomeric SMILES

CCCCC1=C(NC(=N1)SCC(=O)NC2=C(C(=C(N2)CC3=CC=CC=C3)C)C#N)C

InChI

InChI=1S/C23H27N5OS/c1-4-5-11-19-16(3)25-23(27-19)30-14-21(29)28-22-18(13-24)15(2)20(26-22)12-17-9-7-6-8-10-17/h6-10,26H,4-5,11-12,14H2,1-3H3,(H,25,27)(H,28,29)