(1-azanyl-3-phenyl-propyl)-[(4-methoxyphenyl)methylcarbamothioyl]phosphinic acid

Systemtic Name: (1-azanyl-3-phenyl-propyl)-[(4-methoxyphenyl)methylcarbamothioyl]phosphinic acid Openeye Name: (1-amino-3-phenyl-propyl)-[(4-methoxyphenyl)methylcarbamothioyl]phosphinic acid CAS Name: (1-amino-3-phenylpropyl)-[[(4-methoxyphenyl)methylamino]-sulfanylidenemethyl]phosphinic acid IUPAC Name: (1-amino-3-phenylpropyl)-[(4-methoxyphenyl)methylcarbamothioyl]phosphinic acid Traditional Name: (1-amino-3-phenyl-propyl)-(p-anisylthiocarbamoyl)phosphinic acid Formula: C18H23N2O3PS MolecularWeight: 378.425581

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=S)P(=O)(C(CCC2=CC=CC=C2)N)O

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=S)P(=O)(C(CCC2=CC=CC=C2)N)O

InChI

InChI=1S/C18H23N2O3PS/c1-23-16-10-7-15(8-11-16)13-20-18(25)24(21,22)17(19)12-9-14-5-3-2-4-6-14/h2-8,10-11,17H,9,12-13,19H2,1H3,(H,20,25)(H,21,22)