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2-(ethylcarbamothioylamino)butanedioic acid

2-(ethylcarbamothioylamino)butanedioic acid

Systemtic Name:2-(ethylcarbamothioylamino)butanedioic acid
Openeye Name:2-(ethylcarbamothioylamino)butanedioic acid
CAS Name:2-[[ethylamino(sulfanylidene)methyl]amino]butanedioic acid
IUPAC Name:2-(ethylcarbamothioylamino)butanedioic acid
Traditional Name:2-(ethylthiocarbamoylamino)succinic acid
Formula: C7H12N2O4S
MolecularWeight: 220.24618
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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)NC(CC(=O)O)C(=O)O


Isomeric SMILES

CCNC(=S)NC(CC(=O)O)C(=O)O


InChI

InChI=1S/C7H12N2O4S/c1-2-8-7(14)9-4(6(12)13)3-5(10)11/h4H,2-3H2,1H3,(H,10,11)(H,12,13)(H2,8,9,14)


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