diethyl 2-[[(4-ethoxyphenyl)carbamothioylamino]methylidene]propanedioate

Systemtic Name: diethyl 2-[[(4-ethoxyphenyl)carbamothioylamino]methylidene]propanedioate Openeye Name: diethyl 2-[[(4-ethoxyphenyl)carbamothioylamino]methylene]propanedioate CAS Name: 2-[[[(4-ethoxyanilino)-sulfanylidenemethyl]amino]methylidene]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[[(4-ethoxyphenyl)carbamothioylamino]methylidene]propanedioate Traditional Name: 2-[(p-phenetylthiocarbamoylamino)methylene]malonic acid diethyl ester Formula: C17H22N2O5S MolecularWeight: 366.43198

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=S)NC=C(C(=O)OCC)C(=O)OCC

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=S)NC=C(C(=O)OCC)C(=O)OCC

InChI

InChI=1S/C17H22N2O5S/c1-4-22-13-9-7-12(8-10-13)19-17(25)18-11-14(15(20)23-5-2)16(21)24-6-3/h7-11H,4-6H2,1-3H3,(H2,18,19,25)