2-[3-[(2S)-4-[(2R)-2-azanyl-3-(4-chlorophenyl)propanoyl]-1-(2-naphthalen-2-ylethyl)piperazin-2-yl]propyl]guanidine

Systemtic Name: 2-[3-[(2S)-4-[(2R)-2-azanyl-3-(4-chlorophenyl)propanoyl]-1-(2-naphthalen-2-ylethyl)piperazin-2-yl]propyl]guanidine Openeye Name: 2-[3-[(2S)-4-[(2R)-2-amino-3-(4-chlorophenyl)propanoyl]-1-[2-(2-naphthyl)ethyl]piperazin-2-yl]propyl]guanidine CAS Name: 2-[3-[(2S)-4-[(2R)-2-amino-3-(4-chlorophenyl)-1-oxopropyl]-1-[2-(2-naphthalenyl)ethyl]-2-piperazinyl]propyl]guanidine IUPAC Name: 2-[3-[(2S)-4-[(2R)-2-amino-3-(4-chlorophenyl)propanoyl]-1-(2-naphthalen-2-ylethyl)piperazin-2-yl]propyl]guanidine Traditional Name: 2-[3-[(2S)-4-[(2R)-2-amino-3-(4-chlorophenyl)propanoyl]-1-[2-(2-naphthyl)ethyl]piperazin-2-yl]propyl]guanidine Formula: C29H37ClN6O MolecularWeight: 521.09668

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CN1C(=O)C(CC2=CC=C(C=C2)Cl)N)CCCN=C(N)N)CCC3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1CN([C@H](CN1C(=O)[C@@H](CC2=CC=C(C=C2)Cl)N)CCCN=C(N)N)CCC3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C29H37ClN6O/c30-25-11-8-21(9-12-25)19-27(31)28(37)36-17-16-35(26(20-36)6-3-14-34-29(32)33)15-13-22-7-10-23-4-1-2-5-24(23)18-22/h1-2,4-5,7-12,18,26-27H,3,6,13-17,19-20,31H2,(H4,32,33,34)/t26-,27+/m0/s1