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

Systemtic Name: N-[[4-(1,3-benzothiazol-2-yl)phenyl]methyl-ethoxy-phosphoryl]-1-phenyl-methanamine Openeye Name: N-[[4-(1,3-benzothiazol-2-yl)phenyl]methyl-ethoxy-phosphoryl]-1-phenyl-methanamine CAS Name: N-[[4-(1,3-benzothiazol-2-yl)phenyl]methyl-ethoxyphosphoryl]-1-phenylmethanamine IUPAC Name: N-[[4-(1,3-benzothiazol-2-yl)phenyl]methyl-ethoxyphosphoryl]-1-phenylmethanamine Traditional Name: [[4-(1,3-benzothiazol-2-yl)benzyl]-ethoxy-phosphoryl]-benzyl-amine Formula: C23H23N2O2PS MolecularWeight: 422.479681

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(CC1=CC=C(C=C1)C2=NC3=CC=CC=C3S2)NCC4=CC=CC=C4

Isomeric SMILES

CCOP(=O)(CC1=CC=C(C=C1)C2=NC3=CC=CC=C3S2)NCC4=CC=CC=C4

InChI

InChI=1S/C23H23N2O2PS/c1-2-27-28(26,24-16-18-8-4-3-5-9-18)17-19-12-14-20(15-13-19)23-25-21-10-6-7-11-22(21)29-23/h3-15H,2,16-17H2,1H3,(H,24,26)