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

Systemtic Name: 2-[3-[(5R)-1-[(2S)-2-azanyl-3-(2,4-dichlorophenyl)propyl]-5-(2-methylpropyl)-4-(2-naphthalen-2-ylethanoyl)piperazin-2-yl]propyl]guanidine Openeye Name: 2-[3-[(5R)-1-[(2S)-2-amino-3-(2,4-dichlorophenyl)propyl]-5-isobutyl-4-[2-(2-naphthyl)acetyl]piperazin-2-yl]propyl]guanidine CAS Name: 2-[3-[(5R)-1-[(2S)-2-amino-3-(2,4-dichlorophenyl)propyl]-5-(2-methylpropyl)-4-[2-(2-naphthalenyl)-1-oxoethyl]-2-piperazinyl]propyl]guanidine IUPAC Name: 2-[3-[(5R)-1-[(2S)-2-amino-3-(2,4-dichlorophenyl)propyl]-5-(2-methylpropyl)-4-(2-naphthalen-2-ylacetyl)piperazin-2-yl]propyl]guanidine Traditional Name: 2-[3-[(5R)-1-[(2S)-2-amino-3-(2,4-dichlorophenyl)propyl]-5-isobutyl-4-[2-(2-naphthyl)acetyl]piperazin-2-yl]propyl]guanidine Formula: C33H44Cl2N6O MolecularWeight: 611.64806

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C33H44Cl2N6O/c1-22(2)14-30-20-40(19-28(36)17-26-11-12-27(34)18-31(26)35)29(8-5-13-39-33(37)38)21-41(30)32(42)16-23-9-10-24-6-3-4-7-25(24)15-23/h3-4,6-7,9-12,15,18,22,28-30H,5,8,13-14,16-17,19-21,36H2,1-2H3,(H4,37,38,39)/t28-,29?,30+/m0/s1