N-(4-butylphenyl)-2-[1-(3-chlorophenyl)imidazol-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(4-butylphenyl)-2-[1-(3-chlorophenyl)imidazol-2-yl]sulfanyl-ethanamide Openeye Name: N-(4-butylphenyl)-2-[1-(3-chlorophenyl)imidazol-2-yl]sulfanyl-acetamide CAS Name: N-(4-butylphenyl)-2-[[1-(3-chlorophenyl)-2-imidazolyl]thio]acetamide IUPAC Name: N-(4-butylphenyl)-2-[1-(3-chlorophenyl)imidazol-2-yl]sulfanylacetamide Traditional Name: N-(4-butylphenyl)-2-[[1-(3-chlorophenyl)imidazol-2-yl]thio]acetamide Formula: C21H22ClN3OS MolecularWeight: 399.93688

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)CSC2=NC=CN2C3=CC(=CC=C3)Cl

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)CSC2=NC=CN2C3=CC(=CC=C3)Cl

InChI

InChI=1S/C21H22ClN3OS/c1-2-3-5-16-8-10-18(11-9-16)24-20(26)15-27-21-23-12-13-25(21)19-7-4-6-17(22)14-19/h4,6-14H,2-3,5,15H2,1H3,(H,24,26)