(2R)-N-(5-chloranylpyridin-2-yl)-2-[1-(2-methylpropyl)benzimidazol-2-yl]sulfanyl-propanamide

Systemtic Name: (2R)-N-(5-chloranylpyridin-2-yl)-2-[1-(2-methylpropyl)benzimidazol-2-yl]sulfanyl-propanamide Openeye Name: (2R)-N-(5-chloro-2-pyridyl)-2-(1-isobutylbenzimidazol-2-yl)sulfanyl-propanamide CAS Name: (2R)-N-(5-chloro-2-pyridinyl)-2-[[1-(2-methylpropyl)-2-benzimidazolyl]thio]propanamide IUPAC Name: (2R)-N-(5-chloropyridin-2-yl)-2-[1-(2-methylpropyl)benzimidazol-2-yl]sulfanylpropanamide Traditional Name: (2R)-N-(5-chloro-2-pyridyl)-2-[(1-isobutylbenzimidazol-2-yl)thio]propionamide Formula: C19H21ClN4OS MolecularWeight: 388.91424

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C2=CC=CC=C2N=C1SC(C)C(=O)NC3=NC=C(C=C3)Cl

Isomeric SMILES

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

InChI

InChI=1S/C19H21ClN4OS/c1-12(2)11-24-16-7-5-4-6-15(16)22-19(24)26-13(3)18(25)23-17-9-8-14(20)10-21-17/h4-10,12-13H,11H2,1-3H3,(H,21,23,25)/t13-/m1/s1