S-(dimethylamino) N-[2-(4-ethoxyphenyl)ethanoyl]carbamothioate; 1-methyl-4-(sulfonylamino)cyclohexane

Systemtic Name: S-(dimethylamino) N-[2-(4-ethoxyphenyl)ethanoyl]carbamothioate; 1-methyl-4-(sulfonylamino)cyclohexane Openeye Name: S-(dimethylamino) N-[2-(4-ethoxyphenyl)acetyl]carbamothioate; 1-methyl-4-(sulfonylamino)cyclohexane CAS Name: N-[2-(4-ethoxyphenyl)-1-oxoethyl]carbamothioic acid S-(dimethylamino) ester; 1-methyl-4-(sulfonylamino)cyclohexane IUPAC Name: S-(dimethylamino) N-[2-(4-ethoxyphenyl)acetyl]carbamothioate; 1-methyl-4-(sulfonylamino)cyclohexane Traditional Name: 1-methyl-4-(sulfonylamino)cyclohexane; N-(2-p-phenetylacetyl)thiocarbamic acid S-(dimethylamino) ester Formula: C20H31N3O5S2 MolecularWeight: 457.60724

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CC(=O)NC(=O)SN(C)C.CC1CCC(CC1)N=S(=O)=O

Isomeric SMILES

CCOC1=CC=C(C=C1)CC(=O)NC(=O)SN(C)C.CC1CCC(CC1)N=S(=O)=O

InChI

InChI=1S/C13H18N2O3S.C7H13NO2S/c1-4-18-11-7-5-10(6-8-11)9-12(16)14-13(17)19-15(2)3;1-6-2-4-7(5-3-6)8-11(9)10/h5-8H,4,9H2,1-3H3,(H,14,16,17);6-7H,2-5H2,1H3