(phenylmethyl) 2-[(1R)-1-[[(2S)-2-(cyclohexylcarbamoylamino)-4-methyl-pentanoyl]amino]-2-(1-ethylindol-3-yl)ethyl]-5-methyl-1,3-oxazole-4-carboxylate

Systemtic Name: (phenylmethyl) 2-[(1R)-1-[[(2S)-2-(cyclohexylcarbamoylamino)-4-methyl-pentanoyl]amino]-2-(1-ethylindol-3-yl)ethyl]-5-methyl-1,3-oxazole-4-carboxylate Openeye Name: benzyl 2-[(1R)-1-[[(2S)-2-(cyclohexylcarbamoylamino)-4-methyl-pentanoyl]amino]-2-(1-ethylindol-3-yl)ethyl]-5-methyl-oxazole-4-carboxylate CAS Name: 2-[(1R)-1-[[(2S)-2-[[(cyclohexylamino)-oxomethyl]amino]-4-methyl-1-oxopentyl]amino]-2-(1-ethyl-3-indolyl)ethyl]-5-methyl-4-oxazolecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[(1R)-1-[[(2S)-2-(cyclohexylcarbamoylamino)-4-methylpentanoyl]amino]-2-(1-ethylindol-3-yl)ethyl]-5-methyl-1,3-oxazole-4-carboxylate Traditional Name: 2-[(1R)-1-[[(2S)-2-(cyclohexylcarbamoylamino)-4-methyl-pentanoyl]amino]-2-(1-ethylindol-3-yl)ethyl]-5-methyl-oxazole-4-carboxylic acid benzyl ester Formula: C37H47N5O5 MolecularWeight: 641.79958

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C2=CC=CC=C21)CC(C3=NC(=C(O3)C)C(=O)OCC4=CC=CC=C4)NC(=O)C(CC(C)C)NC(=O)NC5CCCCC5

Isomeric SMILES

CCN1C=C(C2=CC=CC=C21)C[C@H](C3=NC(=C(O3)C)C(=O)OCC4=CC=CC=C4)NC(=O)[C@H](CC(C)C)NC(=O)NC5CCCCC5

InChI

InChI=1S/C37H47N5O5/c1-5-42-22-27(29-18-12-13-19-32(29)42)21-31(35-41-33(25(4)47-35)36(44)46-23-26-14-8-6-9-15-26)39-34(43)30(20-24(2)3)40-37(45)38-28-16-10-7-11-17-28/h6,8-9,12-15,18-19,22,24,28,30-31H,5,7,10-11,16-17,20-21,23H2,1-4H3,(H,39,43)(H2,38,40,45)/t30-,31+/m0/s1