2-azanyl-3-(cyclohexylmethyl)-5-(3-naphthalen-1-ylpropanoylamino)-2-oxidanyl-4-oxidanylidene-6-[2-(1-oxidanylpropan-2-ylcarbamoyl)-1H-imidazol-5-yl]hexanoic acid

Systemtic Name: 2-azanyl-3-(cyclohexylmethyl)-5-(3-naphthalen-1-ylpropanoylamino)-2-oxidanyl-4-oxidanylidene-6-[2-(1-oxidanylpropan-2-ylcarbamoyl)-1H-imidazol-5-yl]hexanoic acid Openeye Name: 2-amino-3-(cyclohexylmethyl)-2-hydroxy-6-[2-[(2-hydroxy-1-methyl-ethyl)carbamoyl]-1H-imidazol-5-yl]-5-[3-(1-naphthyl)propanoylamino]-4-oxo-hexanoic acid CAS Name: 2-amino-3-(cyclohexylmethyl)-2-hydroxy-6-[2-[(1-hydroxypropan-2-ylamino)-oxomethyl]-1H-imidazol-5-yl]-5-[[3-(1-naphthalenyl)-1-oxopropyl]amino]-4-oxohexanoic acid IUPAC Name: 2-amino-3-(cyclohexylmethyl)-2-hydroxy-6-[2-(1-hydroxypropan-2-ylcarbamoyl)-1H-imidazol-5-yl]-5-(3-naphthalen-1-ylpropanoylamino)-4-oxohexanoic acid Traditional Name: 2-amino-3-(cyclohexylmethyl)-2-hydroxy-6-[2-[(2-hydroxy-1-methyl-ethyl)carbamoyl]-1H-imidazol-5-yl]-4-keto-5-[3-(1-naphthyl)propanoylamino]hexanoic acid Formula: C33H43N5O7 MolecularWeight: 621.72382

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Descriptors Computed from Structure

Canonical SMILES:

CC(CO)NC(=O)C1=NC=C(N1)CC(C(=O)C(CC2CCCCC2)C(C(=O)O)(N)O)NC(=O)CCC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC(CO)NC(=O)C1=NC=C(N1)CC(C(=O)C(CC2CCCCC2)C(C(=O)O)(N)O)NC(=O)CCC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C33H43N5O7/c1-20(19-39)36-31(42)30-35-18-24(37-30)17-27(29(41)26(33(34,45)32(43)44)16-21-8-3-2-4-9-21)38-28(40)15-14-23-12-7-11-22-10-5-6-13-25(22)23/h5-7,10-13,18,20-21,26-27,39,45H,2-4,8-9,14-17,19,34H2,1H3,(H,35,37)(H,36,42)(H,38,40)(H,43,44)