N-[(R)-diethoxyphosphoryl-(3-methylphenyl)methyl]-6-methyl-1,3-benzothiazol-2-amine

Systemtic Name: N-[(R)-diethoxyphosphoryl-(3-methylphenyl)methyl]-6-methyl-1,3-benzothiazol-2-amine Openeye Name: N-[(R)-diethoxyphosphoryl(m-tolyl)methyl]-6-methyl-1,3-benzothiazol-2-amine CAS Name: N-[(R)-diethoxyphosphoryl-(3-methylphenyl)methyl]-6-methyl-1,3-benzothiazol-2-amine IUPAC Name: N-[(R)-diethoxyphosphoryl-(3-methylphenyl)methyl]-6-methyl-1,3-benzothiazol-2-amine Traditional Name: [(R)-diethoxyphosphoryl(m-tolyl)methyl]-(6-methyl-1,3-benzothiazol-2-yl)amine Formula: C20H25N2O3PS MolecularWeight: 404.462861

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C(C1=CC=CC(=C1)C)NC2=NC3=C(S2)C=C(C=C3)C)OCC

Isomeric SMILES

CCOP(=O)([C@H](C1=CC=CC(=C1)C)NC2=NC3=C(S2)C=C(C=C3)C)OCC

InChI

InChI=1S/C20H25N2O3PS/c1-5-24-26(23,25-6-2)19(16-9-7-8-14(3)12-16)22-20-21-17-11-10-15(4)13-18(17)27-20/h7-13,19H,5-6H2,1-4H3,(H,21,22)/t19-/m1/s1