(2R)-N-(4-acetamidophenyl)-2-(5-chloranyl-1-propyl-benzimidazol-2-yl)sulfanyl-propanamide

Systemtic Name: (2R)-N-(4-acetamidophenyl)-2-(5-chloranyl-1-propyl-benzimidazol-2-yl)sulfanyl-propanamide Openeye Name: (2R)-N-(4-acetamidophenyl)-2-(5-chloro-1-propyl-benzimidazol-2-yl)sulfanyl-propanamide CAS Name: (2R)-N-(4-acetamidophenyl)-2-[(5-chloro-1-propyl-2-benzimidazolyl)thio]propanamide IUPAC Name: (2R)-N-(4-acetamidophenyl)-2-(5-chloro-1-propylbenzimidazol-2-yl)sulfanylpropanamide Traditional Name: (2R)-N-(4-acetamidophenyl)-2-[(5-chloro-1-propyl-benzimidazol-2-yl)thio]propionamide Formula: C21H23ClN4O2S MolecularWeight: 430.95092

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)Cl)N=C1SC(C)C(=O)NC3=CC=C(C=C3)NC(=O)C

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)Cl)N=C1S[C@H](C)C(=O)NC3=CC=C(C=C3)NC(=O)C

InChI

InChI=1S/C21H23ClN4O2S/c1-4-11-26-19-10-5-15(22)12-18(19)25-21(26)29-13(2)20(28)24-17-8-6-16(7-9-17)23-14(3)27/h5-10,12-13H,4,11H2,1-3H3,(H,23,27)(H,24,28)/t13-/m1/s1