ethyl 2-[(1S)-1-[[(2S)-2-(2,2-diphenylethanoylamino)-4-methyl-pentanoyl]amino]-2-phenyl-ethyl]-1,3-dithiolane-2-carboxylate

Systemtic Name: ethyl 2-[(1S)-1-[[(2S)-2-(2,2-diphenylethanoylamino)-4-methyl-pentanoyl]amino]-2-phenyl-ethyl]-1,3-dithiolane-2-carboxylate Openeye Name: ethyl 2-[(1S)-1-[[(2S)-2-[(2,2-diphenylacetyl)amino]-4-methyl-pentanoyl]amino]-2-phenyl-ethyl]-1,3-dithiolane-2-carboxylate CAS Name: 2-[(1S)-1-[[(2S)-4-methyl-1-oxo-2-[(1-oxo-2,2-diphenylethyl)amino]pentyl]amino]-2-phenylethyl]-1,3-dithiolane-2-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[(1S)-1-[[(2S)-2-[(2,2-diphenylacetyl)amino]-4-methylpentanoyl]amino]-2-phenylethyl]-1,3-dithiolane-2-carboxylate Traditional Name: 2-[(1S)-1-[[(2S)-2-[(2,2-diphenylacetyl)amino]-4-methyl-pentanoyl]amino]-2-phenyl-ethyl]-1,3-dithiolane-2-carboxylic acid ethyl ester Formula: C34H40N2O4S2 MolecularWeight: 604.8224

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(SCCS1)C(CC2=CC=CC=C2)NC(=O)C(CC(C)C)NC(=O)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1(SCCS1)[C@H](CC2=CC=CC=C2)NC(=O)[C@H](CC(C)C)NC(=O)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C34H40N2O4S2/c1-4-40-33(39)34(41-20-21-42-34)29(23-25-14-8-5-9-15-25)36-31(37)28(22-24(2)3)35-32(38)30(26-16-10-6-11-17-26)27-18-12-7-13-19-27/h5-19,24,28-30H,4,20-23H2,1-3H3,(H,35,38)(H,36,37)/t28-,29-/m0/s1