(phenylmethyl) N-[(5S)-5-[[(2S)-2-azanyl-3-phenylmethoxy-propanoyl]amino]-6-(3-cyclohexylpropylamino)-6-oxidanylidene-hexyl]carbamate

Systemtic Name: (phenylmethyl) N-[(5S)-5-[[(2S)-2-azanyl-3-phenylmethoxy-propanoyl]amino]-6-(3-cyclohexylpropylamino)-6-oxidanylidene-hexyl]carbamate Openeye Name: benzyl N-[(5S)-5-[[(2S)-2-amino-3-benzyloxy-propanoyl]amino]-6-(3-cyclohexylpropylamino)-6-oxo-hexyl]carbamate CAS Name: N-[(5S)-5-[[(2S)-2-amino-1-oxo-3-phenylmethoxypropyl]amino]-6-(3-cyclohexylpropylamino)-6-oxohexyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(5S)-5-[[(2S)-2-amino-3-phenylmethoxypropanoyl]amino]-6-(3-cyclohexylpropylamino)-6-oxohexyl]carbamate Traditional Name: N-[(5S)-5-[[(2S)-2-amino-3-benzoxy-propanoyl]amino]-6-(3-cyclohexylpropylamino)-6-keto-hexyl]carbamic acid benzyl ester Formula: C33H48N4O5 MolecularWeight: 580.75802

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CCCNC(=O)C(CCCCNC(=O)OCC2=CC=CC=C2)NC(=O)C(COCC3=CC=CC=C3)N

Isomeric SMILES

C1CCC(CC1)CCCNC(=O)[C@H](CCCCNC(=O)OCC2=CC=CC=C2)NC(=O)[C@H](COCC3=CC=CC=C3)N

InChI

InChI=1S/C33H48N4O5/c34-29(25-41-23-27-15-6-2-7-16-27)31(38)37-30(32(39)35-22-12-19-26-13-4-1-5-14-26)20-10-11-21-36-33(40)42-24-28-17-8-3-9-18-28/h2-3,6-9,15-18,26,29-30H,1,4-5,10-14,19-25,34H2,(H,35,39)(H,36,40)(H,37,38)/t29-,30-/m0/s1