2-[3-[(2S,5R)-1-[(2R)-2-azanyl-3-(2,4-dimethylphenyl)propanoyl]-5-methyl-4-(2-naphthalen-2-ylethanoyl)piperazin-2-yl]propyl]guanidine

Systemtic Name: 2-[3-[(2S,5R)-1-[(2R)-2-azanyl-3-(2,4-dimethylphenyl)propanoyl]-5-methyl-4-(2-naphthalen-2-ylethanoyl)piperazin-2-yl]propyl]guanidine Openeye Name: 2-[3-[(2S,5R)-1-[(2R)-2-amino-3-(2,4-dimethylphenyl)propanoyl]-5-methyl-4-[2-(2-naphthyl)acetyl]piperazin-2-yl]propyl]guanidine CAS Name: 2-[3-[(2S,5R)-1-[(2R)-2-amino-3-(2,4-dimethylphenyl)-1-oxopropyl]-5-methyl-4-[2-(2-naphthalenyl)-1-oxoethyl]-2-piperazinyl]propyl]guanidine IUPAC Name: 2-[3-[(2S,5R)-1-[(2R)-2-amino-3-(2,4-dimethylphenyl)propanoyl]-5-methyl-4-(2-naphthalen-2-ylacetyl)piperazin-2-yl]propyl]guanidine Traditional Name: 2-[3-[(2S,5R)-1-[(2R)-2-amino-3-(2,4-dimethylphenyl)propanoyl]-5-methyl-4-[2-(2-naphthyl)acetyl]piperazin-2-yl]propyl]guanidine Formula: C32H42N6O2 MolecularWeight: 542.71488

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(C(CN1C(=O)CC2=CC3=CC=CC=C3C=C2)CCCN=C(N)N)C(=O)C(CC4=C(C=C(C=C4)C)C)N

Isomeric SMILES

C[C@@H]1CN([C@H](CN1C(=O)CC2=CC3=CC=CC=C3C=C2)CCCN=C(N)N)C(=O)[C@@H](CC4=C(C=C(C=C4)C)C)N

InChI

InChI=1S/C32H42N6O2/c1-21-10-12-26(22(2)15-21)18-29(33)31(40)38-19-23(3)37(20-28(38)9-6-14-36-32(34)35)30(39)17-24-11-13-25-7-4-5-8-27(25)16-24/h4-5,7-8,10-13,15-16,23,28-29H,6,9,14,17-20,33H2,1-3H3,(H4,34,35,36)/t23-,28+,29-/m1/s1