N-[[4-(1,3-benzothiazol-2-yl)phenyl]methyl-ethoxy-phosphoryl]-N-ethyl-ethanamine

Systemtic Name: N-[[4-(1,3-benzothiazol-2-yl)phenyl]methyl-ethoxy-phosphoryl]-N-ethyl-ethanamine Openeye Name: N-[[4-(1,3-benzothiazol-2-yl)phenyl]methyl-ethoxy-phosphoryl]-N-ethyl-ethanamine CAS Name: N-[[4-(1,3-benzothiazol-2-yl)phenyl]methyl-ethoxyphosphoryl]-N-ethylethanamine IUPAC Name: N-[[4-(1,3-benzothiazol-2-yl)phenyl]methyl-ethoxyphosphoryl]-N-ethylethanamine Traditional Name: [[4-(1,3-benzothiazol-2-yl)benzyl]-ethoxy-phosphoryl]-diethyl-amine Formula: C20H25N2O2PS MolecularWeight: 388.463461

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)P(=O)(CC1=CC=C(C=C1)C2=NC3=CC=CC=C3S2)OCC

Isomeric SMILES

CCN(CC)P(=O)(CC1=CC=C(C=C1)C2=NC3=CC=CC=C3S2)OCC

InChI

InChI=1S/C20H25N2O2PS/c1-4-22(5-2)25(23,24-6-3)15-16-11-13-17(14-12-16)20-21-18-9-7-8-10-19(18)26-20/h7-14H,4-6,15H2,1-3H3