2-[5-chloranyl-1-(phenylmethyl)benzimidazol-2-yl]sulfanyl-N-prop-2-enyl-propanamide

Systemtic Name: 2-[5-chloranyl-1-(phenylmethyl)benzimidazol-2-yl]sulfanyl-N-prop-2-enyl-propanamide Openeye Name: N-allyl-2-(1-benzyl-5-chloro-benzimidazol-2-yl)sulfanyl-propanamide CAS Name: 2-[[5-chloro-1-(phenylmethyl)-2-benzimidazolyl]thio]-N-prop-2-enylpropanamide IUPAC Name: 2-(1-benzyl-5-chlorobenzimidazol-2-yl)sulfanyl-N-prop-2-enylpropanamide Traditional Name: N-allyl-2-[(1-benzyl-5-chloro-benzimidazol-2-yl)thio]propionamide Formula: C20H20ClN3OS MolecularWeight: 385.9103

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC=C)SC1=NC2=C(N1CC3=CC=CC=C3)C=CC(=C2)Cl

Isomeric SMILES

CC(C(=O)NCC=C)SC1=NC2=C(N1CC3=CC=CC=C3)C=CC(=C2)Cl

InChI

InChI=1S/C20H20ClN3OS/c1-3-11-22-19(25)14(2)26-20-23-17-12-16(21)9-10-18(17)24(20)13-15-7-5-4-6-8-15/h3-10,12,14H,1,11,13H2,2H3,(H,22,25)