N-(2-bromanyl-4-methyl-phenyl)-2-[1-(3-methoxyphenyl)imidazol-2-yl]sulfanyl-propanamide

Systemtic Name: N-(2-bromanyl-4-methyl-phenyl)-2-[1-(3-methoxyphenyl)imidazol-2-yl]sulfanyl-propanamide Openeye Name: N-(2-bromo-4-methyl-phenyl)-2-[1-(3-methoxyphenyl)imidazol-2-yl]sulfanyl-propanamide CAS Name: N-(2-bromo-4-methylphenyl)-2-[[1-(3-methoxyphenyl)-2-imidazolyl]thio]propanamide IUPAC Name: N-(2-bromo-4-methylphenyl)-2-[1-(3-methoxyphenyl)imidazol-2-yl]sulfanylpropanamide Traditional Name: N-(2-bromo-4-methyl-phenyl)-2-[[1-(3-methoxyphenyl)imidazol-2-yl]thio]propionamide Formula: C20H20BrN3O2S MolecularWeight: 446.3607

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C(C)SC2=NC=CN2C3=CC(=CC=C3)OC)Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C(C)SC2=NC=CN2C3=CC(=CC=C3)OC)Br

InChI

InChI=1S/C20H20BrN3O2S/c1-13-7-8-18(17(21)11-13)23-19(25)14(2)27-20-22-9-10-24(20)15-5-4-6-16(12-15)26-3/h4-12,14H,1-3H3,(H,23,25)