2-(1-butyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-N-(4-pyrrolidin-1-ylphenyl)ethanamide

Systemtic Name: 2-(1-butyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-N-(4-pyrrolidin-1-ylphenyl)ethanamide Openeye Name: 2-(1-butyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-N-(4-pyrrolidin-1-ylphenyl)acetamide CAS Name: 2-[(1-butyl-4,5-dimethyl-2-imidazolyl)thio]-N-[4-(1-pyrrolidinyl)phenyl]acetamide IUPAC Name: 2-(1-butyl-4,5-dimethylimidazol-2-yl)sulfanyl-N-(4-pyrrolidin-1-ylphenyl)acetamide Traditional Name: 2-[(1-butyl-4,5-dimethyl-imidazol-2-yl)thio]-N-(4-pyrrolidinophenyl)acetamide Formula: C21H30N4OS MolecularWeight: 386.5541

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(N=C1SCC(=O)NC2=CC=C(C=C2)N3CCCC3)C)C

Isomeric SMILES

CCCCN1C(=C(N=C1SCC(=O)NC2=CC=C(C=C2)N3CCCC3)C)C

InChI

InChI=1S/C21H30N4OS/c1-4-5-14-25-17(3)16(2)22-21(25)27-15-20(26)23-18-8-10-19(11-9-18)24-12-6-7-13-24/h8-11H,4-7,12-15H2,1-3H3,(H,23,26)