N-[(S)-(3-chlorophenyl)-diethoxyphosphoryl-methyl]-6-methyl-1,3-benzothiazol-2-amine

Systemtic Name: N-[(S)-(3-chlorophenyl)-diethoxyphosphoryl-methyl]-6-methyl-1,3-benzothiazol-2-amine Openeye Name: N-[(S)-(3-chlorophenyl)-diethoxyphosphoryl-methyl]-6-methyl-1,3-benzothiazol-2-amine CAS Name: N-[(S)-(3-chlorophenyl)-diethoxyphosphorylmethyl]-6-methyl-1,3-benzothiazol-2-amine IUPAC Name: N-[(S)-(3-chlorophenyl)-diethoxyphosphorylmethyl]-6-methyl-1,3-benzothiazol-2-amine Traditional Name: [(S)-(3-chlorophenyl)-diethoxyphosphoryl-methyl]-(6-methyl-1,3-benzothiazol-2-yl)amine Formula: C19H22ClN2O3PS MolecularWeight: 424.881341

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22ClN2O3PS/c1-4-24-26(23,25-5-2)18(14-7-6-8-15(20)12-14)22-19-21-16-10-9-13(3)11-17(16)27-19/h6-12,18H,4-5H2,1-3H3,(H,21,22)/t18-/m0/s1