methyl 2-[[(2S)-1-[2-(1-methylbenzimidazol-2-yl)sulfanylethanoyl]pyrrolidin-2-yl]carbonylamino]-2-phenyl-ethanoate

Systemtic Name: methyl 2-[[(2S)-1-[2-(1-methylbenzimidazol-2-yl)sulfanylethanoyl]pyrrolidin-2-yl]carbonylamino]-2-phenyl-ethanoate Openeye Name: methyl 2-[[(2S)-1-[2-(1-methylbenzimidazol-2-yl)sulfanylacetyl]pyrrolidine-2-carbonyl]amino]-2-phenyl-acetate CAS Name: 2-[[[(2S)-1-[2-[(1-methyl-2-benzimidazolyl)thio]-1-oxoethyl]-2-pyrrolidinyl]-oxomethyl]amino]-2-phenylacetic acid methyl ester IUPAC Name: methyl 2-[[(2S)-1-[2-(1-methylbenzimidazol-2-yl)sulfanylacetyl]pyrrolidine-2-carbonyl]amino]-2-phenylacetate Traditional Name: 2-[[(2S)-1-[2-[(1-methylbenzimidazol-2-yl)thio]acetyl]prolyl]amino]-2-phenyl-acetic acid methyl ester Formula: C24H26N4O4S MolecularWeight: 466.55264

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N=C1SCC(=O)N3CCCC3C(=O)NC(C4=CC=CC=C4)C(=O)OC

Isomeric SMILES

CN1C2=CC=CC=C2N=C1SCC(=O)N3CCC[C@H]3C(=O)NC(C4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C24H26N4O4S/c1-27-18-12-7-6-11-17(18)25-24(27)33-15-20(29)28-14-8-13-19(28)22(30)26-21(23(31)32-2)16-9-4-3-5-10-16/h3-7,9-12,19,21H,8,13-15H2,1-2H3,(H,26,30)/t19-,21?/m0/s1