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2-[cyanomethyl-[(3-ethoxyphenyl)methylsulfonyl]amino]ethanethioamide

2-[cyanomethyl-[(3-ethoxyphenyl)methylsulfonyl]amino]ethanethioamide

Systemtic Name:2-[cyanomethyl-[(3-ethoxyphenyl)methylsulfonyl]amino]ethanethioamide
Openeye Name:2-[cyanomethyl-[(3-ethoxyphenyl)methylsulfonyl]amino]thioacetamide
CAS Name:2-[cyanomethyl-[(3-ethoxyphenyl)methylsulfonyl]amino]ethanethioamide
IUPAC Name:2-[cyanomethyl-[(3-ethoxyphenyl)methylsulfonyl]amino]ethanethioamide
Traditional Name:2-[cyanomethyl-(3-ethoxybenzyl)sulfonyl-amino]thioacetamide
Formula: C13H17N3O3S2
MolecularWeight: 327.42238
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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)CS(=O)(=O)N(CC#N)CC(=S)N


Isomeric SMILES

CCOC1=CC=CC(=C1)CS(=O)(=O)N(CC#N)CC(=S)N


InChI

InChI=1S/C13H17N3O3S2/c1-2-19-12-5-3-4-11(8-12)10-21(17,18)16(7-6-14)9-13(15)20/h3-5,8H,2,7,9-10H2,1H3,(H2,15,20)


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