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4-(pyridin-2-ylcarbamothioylamino)butylcarbamic acid

4-(pyridin-2-ylcarbamothioylamino)butylcarbamic acid

Systemtic Name:4-(pyridin-2-ylcarbamothioylamino)butylcarbamic acid
Openeye Name:4-(2-pyridylcarbamothioylamino)butylcarbamic acid
CAS Name:4-[[(2-pyridinylamino)-sulfanylidenemethyl]amino]butylcarbamic acid
IUPAC Name:4-(pyridin-2-ylcarbamothioylamino)butylcarbamic acid
Traditional Name:4-(2-pyridylthiocarbamoylamino)butylcarbamic acid
Formula: C11H16N4O2S
MolecularWeight: 268.33534
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)NC(=S)NCCCCNC(=O)O


Isomeric SMILES

C1=CC=NC(=C1)NC(=S)NCCCCNC(=O)O


InChI

InChI=1S/C11H16N4O2S/c16-11(17)14-8-4-3-7-13-10(18)15-9-5-1-2-6-12-9/h1-2,5-6,14H,3-4,7-8H2,(H,16,17)(H2,12,13,15,18)


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