2-[6-[4-[(2S)-2-azanyl-3-phenyl-propanoyl]piperazin-1-yl]-6-oxidanylidene-hexyl]guanidine

Systemtic Name: 2-[6-[4-[(2S)-2-azanyl-3-phenyl-propanoyl]piperazin-1-yl]-6-oxidanylidene-hexyl]guanidine Openeye Name: 2-[6-[4-[(2S)-2-amino-3-phenyl-propanoyl]piperazin-1-yl]-6-oxo-hexyl]guanidine CAS Name: 2-[6-[4-[(2S)-2-amino-1-oxo-3-phenylpropyl]-1-piperazinyl]-6-oxohexyl]guanidine IUPAC Name: 2-[6-[4-[(2S)-2-amino-3-phenylpropanoyl]piperazin-1-yl]-6-oxohexyl]guanidine Traditional Name: 2-[6-[4-[(2S)-2-amino-3-phenyl-propanoyl]piperazino]-6-keto-hexyl]guanidine Formula: C20H32N6O2 MolecularWeight: 388.50708

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCCCCN=C(N)N)C(=O)C(CC2=CC=CC=C2)N

Isomeric SMILES

C1CN(CCN1C(=O)CCCCCN=C(N)N)C(=O)[C@H](CC2=CC=CC=C2)N

InChI

InChI=1S/C20H32N6O2/c21-17(15-16-7-3-1-4-8-16)19(28)26-13-11-25(12-14-26)18(27)9-5-2-6-10-24-20(22)23/h1,3-4,7-8,17H,2,5-6,9-15,21H2,(H4,22,23,24)/t17-/m0/s1