(2R)-N-(5-chloranyl-2-methoxy-phenyl)-2-(1-prop-2-enylbenzimidazol-2-yl)sulfanyl-propanamide

Systemtic Name: (2R)-N-(5-chloranyl-2-methoxy-phenyl)-2-(1-prop-2-enylbenzimidazol-2-yl)sulfanyl-propanamide Openeye Name: (2R)-2-(1-allylbenzimidazol-2-yl)sulfanyl-N-(5-chloro-2-methoxy-phenyl)propanamide CAS Name: (2R)-N-(5-chloro-2-methoxyphenyl)-2-[(1-prop-2-enyl-2-benzimidazolyl)thio]propanamide IUPAC Name: (2R)-N-(5-chloro-2-methoxyphenyl)-2-(1-prop-2-enylbenzimidazol-2-yl)sulfanylpropanamide Traditional Name: (2R)-2-[(1-allylbenzimidazol-2-yl)thio]-N-(5-chloro-2-methoxy-phenyl)propionamide Formula: C20H20ClN3O2S MolecularWeight: 401.9097

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=CC(=C1)Cl)OC)SC2=NC3=CC=CC=C3N2CC=C

Isomeric SMILES

C[C@H](C(=O)NC1=C(C=CC(=C1)Cl)OC)SC2=NC3=CC=CC=C3N2CC=C

InChI

InChI=1S/C20H20ClN3O2S/c1-4-11-24-17-8-6-5-7-15(17)23-20(24)27-13(2)19(25)22-16-12-14(21)9-10-18(16)26-3/h4-10,12-13H,1,11H2,2-3H3,(H,22,25)/t13-/m1/s1