(2S)-N-(ethylcarbamoyl)-2-[1-(4-methoxyphenyl)benzimidazol-2-yl]sulfanyl-propanamide

Systemtic Name: (2S)-N-(ethylcarbamoyl)-2-[1-(4-methoxyphenyl)benzimidazol-2-yl]sulfanyl-propanamide Openeye Name: (2S)-N-(ethylcarbamoyl)-2-[1-(4-methoxyphenyl)benzimidazol-2-yl]sulfanyl-propanamide CAS Name: (2S)-N-(ethylcarbamoyl)-2-[[1-(4-methoxyphenyl)-2-benzimidazolyl]thio]propanamide IUPAC Name: (2S)-N-(ethylcarbamoyl)-2-[1-(4-methoxyphenyl)benzimidazol-2-yl]sulfanylpropanamide Traditional Name: (2S)-N-(ethylcarbamoyl)-2-[[1-(4-methoxyphenyl)benzimidazol-2-yl]thio]propionamide Formula: C20H22N4O3S MolecularWeight: 398.47868

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC(=O)C(C)SC1=NC2=CC=CC=C2N1C3=CC=C(C=C3)OC

Isomeric SMILES

CCNC(=O)NC(=O)[C@H](C)SC1=NC2=CC=CC=C2N1C3=CC=C(C=C3)OC

InChI

InChI=1S/C20H22N4O3S/c1-4-21-19(26)23-18(25)13(2)28-20-22-16-7-5-6-8-17(16)24(20)14-9-11-15(27-3)12-10-14/h5-13H,4H2,1-3H3,(H2,21,23,25,26)/t13-/m0/s1