(2S)-1-[2-(1-methylbenzimidazol-2-yl)sulfanylethanoyl]-N-[(1S)-1-phenylethyl]pyrrolidine-2-carboxamide

Systemtic Name: (2S)-1-[2-(1-methylbenzimidazol-2-yl)sulfanylethanoyl]-N-[(1S)-1-phenylethyl]pyrrolidine-2-carboxamide Openeye Name: (2S)-1-[2-(1-methylbenzimidazol-2-yl)sulfanylacetyl]-N-[(1S)-1-phenylethyl]pyrrolidine-2-carboxamide CAS Name: (2S)-1-[2-[(1-methyl-2-benzimidazolyl)thio]-1-oxoethyl]-N-[(1S)-1-phenylethyl]-2-pyrrolidinecarboxamide IUPAC Name: (2S)-1-[2-(1-methylbenzimidazol-2-yl)sulfanylacetyl]-N-[(1S)-1-phenylethyl]pyrrolidine-2-carboxamide Traditional Name: (2S)-1-[2-[(1-methylbenzimidazol-2-yl)thio]acetyl]-N-[(1S)-1-phenylethyl]pyrrolidine-2-carboxamide Formula: C23H26N4O2S MolecularWeight: 422.54314

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C2CCCN2C(=O)CSC3=NC4=CC=CC=C4N3C

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)NC(=O)[C@@H]2CCCN2C(=O)CSC3=NC4=CC=CC=C4N3C

InChI

InChI=1S/C23H26N4O2S/c1-16(17-9-4-3-5-10-17)24-22(29)20-13-8-14-27(20)21(28)15-30-23-25-18-11-6-7-12-19(18)26(23)2/h3-7,9-12,16,20H,8,13-15H2,1-2H3,(H,24,29)/t16-,20-/m0/s1