3-[4-[1-azanyl-3-(4-methylthiophen-2-yl)-1-oxidanylidene-propan-2-yl]phenyl]pentan-3-ylphosphonic acid

Systemtic Name: 3-[4-[1-azanyl-3-(4-methylthiophen-2-yl)-1-oxidanylidene-propan-2-yl]phenyl]pentan-3-ylphosphonic acid Openeye Name: [1-[4-[2-amino-1-[(4-methyl-2-thienyl)methyl]-2-oxo-ethyl]phenyl]-1-ethyl-propyl]phosphonic acid CAS Name: 3-[4-[1-amino-3-(4-methyl-2-thiophenyl)-1-oxopropan-2-yl]phenyl]pentan-3-ylphosphonic acid IUPAC Name: 3-[4-[1-amino-3-(4-methylthiophen-2-yl)-1-oxopropan-2-yl]phenyl]pentan-3-ylphosphonic acid Traditional Name: [1-[4-[2-amino-2-keto-1-[(4-methyl-2-thienyl)methyl]ethyl]phenyl]-1-ethyl-propyl]phosphonic acid Formula: C19H26NO4PS MolecularWeight: 395.452801

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C1=CC=C(C=C1)C(CC2=CC(=CS2)C)C(=O)N)P(=O)(O)O

Isomeric SMILES

CCC(CC)(C1=CC=C(C=C1)C(CC2=CC(=CS2)C)C(=O)N)P(=O)(O)O

InChI

InChI=1S/C19H26NO4PS/c1-4-19(5-2,25(22,23)24)15-8-6-14(7-9-15)17(18(20)21)11-16-10-13(3)12-26-16/h6-10,12,17H,4-5,11H2,1-3H3,(H2,20,21)(H2,22,23,24)