(2R)-N-(4-cyanophenyl)-2-[1-(2-methoxyethyl)benzimidazol-2-yl]sulfanyl-propanamide

Systemtic Name: (2R)-N-(4-cyanophenyl)-2-[1-(2-methoxyethyl)benzimidazol-2-yl]sulfanyl-propanamide Openeye Name: (2R)-N-(4-cyanophenyl)-2-[1-(2-methoxyethyl)benzimidazol-2-yl]sulfanyl-propanamide CAS Name: (2R)-N-(4-cyanophenyl)-2-[[1-(2-methoxyethyl)-2-benzimidazolyl]thio]propanamide IUPAC Name: (2R)-N-(4-cyanophenyl)-2-[1-(2-methoxyethyl)benzimidazol-2-yl]sulfanylpropanamide Traditional Name: (2R)-N-(4-cyanophenyl)-2-[[1-(2-methoxyethyl)benzimidazol-2-yl]thio]propionamide Formula: C20H20N4O2S MolecularWeight: 380.4634

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)C#N)SC2=NC3=CC=CC=C3N2CCOC

Isomeric SMILES

C[C@H](C(=O)NC1=CC=C(C=C1)C#N)SC2=NC3=CC=CC=C3N2CCOC

InChI

InChI=1S/C20H20N4O2S/c1-14(19(25)22-16-9-7-15(13-21)8-10-16)27-20-23-17-5-3-4-6-18(17)24(20)11-12-26-2/h3-10,14H,11-12H2,1-2H3,(H,22,25)/t14-/m1/s1