(2R)-2-[1-(4-ethoxyphenyl)benzimidazol-2-yl]sulfanyl-N-(methylcarbamoyl)propanamide

Systemtic Name: (2R)-2-[1-(4-ethoxyphenyl)benzimidazol-2-yl]sulfanyl-N-(methylcarbamoyl)propanamide Openeye Name: (2R)-2-[1-(4-ethoxyphenyl)benzimidazol-2-yl]sulfanyl-N-(methylcarbamoyl)propanamide CAS Name: (2R)-2-[[1-(4-ethoxyphenyl)-2-benzimidazolyl]thio]-N-(methylcarbamoyl)propanamide IUPAC Name: (2R)-2-[1-(4-ethoxyphenyl)benzimidazol-2-yl]sulfanyl-N-(methylcarbamoyl)propanamide Traditional Name: (2R)-N-(methylcarbamoyl)-2-[(1-p-phenetylbenzimidazol-2-yl)thio]propionamide Formula: C20H22N4O3S MolecularWeight: 398.47868

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C3=CC=CC=C3N=C2SC(C)C(=O)NC(=O)NC

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C3=CC=CC=C3N=C2S[C@H](C)C(=O)NC(=O)NC

InChI

InChI=1S/C20H22N4O3S/c1-4-27-15-11-9-14(10-12-15)24-17-8-6-5-7-16(17)22-20(24)28-13(2)18(25)23-19(26)21-3/h5-13H,4H2,1-3H3,(H2,21,23,25,26)/t13-/m1/s1