2-[3-(2-azanylethylamino)propyl]-2-methyl-4-(triphenylmethyl)sulfanyl-pentanoic acid

Systemtic Name: 2-[3-(2-azanylethylamino)propyl]-2-methyl-4-(triphenylmethyl)sulfanyl-pentanoic acid Openeye Name: 2-[3-(2-aminoethylamino)propyl]-2-methyl-4-tritylsulfanyl-pentanoic acid CAS Name: 2-[3-(2-aminoethylamino)propyl]-2-methyl-4-[(triphenylmethyl)thio]pentanoic acid IUPAC Name: 2-[3-(2-aminoethylamino)propyl]-2-methyl-4-tritylsulfanylpentanoic acid Traditional Name: 2-[3-(2-aminoethylamino)propyl]-2-methyl-4-(tritylthio)valeric acid Formula: C30H38N2O2S MolecularWeight: 490.69992

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(C)(CCCNCCN)C(=O)O)SC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC(CC(C)(CCCNCCN)C(=O)O)SC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C30H38N2O2S/c1-24(23-29(2,28(33)34)19-12-21-32-22-20-31)35-30(25-13-6-3-7-14-25,26-15-8-4-9-16-26)27-17-10-5-11-18-27/h3-11,13-18,24,32H,12,19-23,31H2,1-2H3,(H,33,34)