2-[2,5-bis(azanyl)pentanoyl-naphthalen-2-yl-amino]-3-phenyl-propanethioic S-acid

Systemtic Name: 2-[2,5-bis(azanyl)pentanoyl-naphthalen-2-yl-amino]-3-phenyl-propanethioic S-acid Openeye Name: 2-[2,5-diaminopentanoyl(2-naphthyl)amino]-3-phenyl-propanethioic S-acid CAS Name: 2-[(2,5-diamino-1-oxopentyl)-(2-naphthalenyl)amino]-3-phenylpropanethioic S-acid IUPAC Name: 2-[2,5-diaminopentanoyl(naphthalen-2-yl)amino]-3-phenylpropanethioic S-acid Traditional Name: 2-[2,5-diaminopentanoyl(2-naphthyl)amino]-3-phenyl-thiopropionic acid Formula: C24H27N3O2S MolecularWeight: 421.55508

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)S)N(C2=CC3=CC=CC=C3C=C2)C(=O)C(CCCN)N

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)S)N(C2=CC3=CC=CC=C3C=C2)C(=O)C(CCCN)N

InChI

InChI=1S/C24H27N3O2S/c25-14-6-11-21(26)23(28)27(20-13-12-18-9-4-5-10-19(18)16-20)22(24(29)30)15-17-7-2-1-3-8-17/h1-5,7-10,12-13,16,21-22H,6,11,14-15,25-26H2,(H,29,30)