2-[3-[(5R)-1-[(2S)-2-azanyl-3-(2,4-dimethylphenyl)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-dimethylphenyl)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-dimethylphenyl)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-dimethylphenyl)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-dimethylphenyl)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-dimethylphenyl)propyl]-5-isobutyl-4-[2-(2-naphthyl)acetyl]piperazin-2-yl]propyl]guanidine Formula: C35H50N6O MolecularWeight: 570.8111

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)CC(CN2CC(N(CC2CCCN=C(N)N)C(=O)CC3=CC4=CC=CC=C4C=C3)CC(C)C)N)C

Isomeric SMILES

CC1=CC(=C(C=C1)C[C@@H](CN2C[C@H](N(CC2CCCN=C(N)N)C(=O)CC3=CC4=CC=CC=C4C=C3)CC(C)C)N)C

InChI

InChI=1S/C35H50N6O/c1-24(2)16-33-22-40(21-31(36)20-29-13-11-25(3)17-26(29)4)32(10-7-15-39-35(37)38)23-41(33)34(42)19-27-12-14-28-8-5-6-9-30(28)18-27/h5-6,8-9,11-14,17-18,24,31-33H,7,10,15-16,19-23,36H2,1-4H3,(H4,37,38,39)/t31-,32?,33+/m0/s1