N-[[butan-2-yloxy-[2-chloranylethanoyl(methyl)amino]phosphinothioyl]-methyl-carbamoyl]-4-methoxy-benzamide

Systemtic Name: N-[[butan-2-yloxy-[2-chloranylethanoyl(methyl)amino]phosphinothioyl]-methyl-carbamoyl]-4-methoxy-benzamide Openeye Name: N-[[[(2-chloroacetyl)-methyl-amino]-sec-butoxy-phosphinothioyl]-methyl-carbamoyl]-4-methoxy-benzamide CAS Name: N-[[[butan-2-yloxy-[(2-chloro-1-oxoethyl)-methylamino]phosphinothioyl]-methylamino]-oxomethyl]-4-methoxybenzamide IUPAC Name: N-[[butan-2-yloxy-[(2-chloroacetyl)-methylamino]phosphinothioyl]-methylcarbamoyl]-4-methoxybenzamide Traditional Name: N-[[[(2-chloroacetyl)-methyl-amino]-sec-butoxy-thiophosphoryl]-methyl-carbamoyl]-4-methoxy-benzamide Formula: C17H25ClN3O5PS MolecularWeight: 449.889261

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OP(=S)(N(C)C(=O)CCl)N(C)C(=O)NC(=O)C1=CC=C(C=C1)OC

Isomeric SMILES

CCC(C)OP(=S)(N(C)C(=O)CCl)N(C)C(=O)NC(=O)C1=CC=C(C=C1)OC

InChI

InChI=1S/C17H25ClN3O5PS/c1-6-12(2)26-27(28,20(3)15(22)11-18)21(4)17(24)19-16(23)13-7-9-14(25-5)10-8-13/h7-10,12H,6,11H2,1-5H3,(H,19,23,24)