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

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

Systemtic Name:2-[cyanomethyl-[(3-ethylphenyl)methylsulfonyl]amino]ethanethioamide
Openeye Name:2-[cyanomethyl-[(3-ethylphenyl)methylsulfonyl]amino]thioacetamide
CAS Name:2-[cyanomethyl-[(3-ethylphenyl)methylsulfonyl]amino]ethanethioamide
IUPAC Name:2-[cyanomethyl-[(3-ethylphenyl)methylsulfonyl]amino]ethanethioamide
Traditional Name:2-[cyanomethyl-(3-ethylbenzyl)sulfonyl-amino]thioacetamide
Formula: C13H17N3O2S2
MolecularWeight: 311.42298
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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)CS(=O)(=O)N(CC#N)CC(=S)N


Isomeric SMILES

CCC1=CC(=CC=C1)CS(=O)(=O)N(CC#N)CC(=S)N


InChI

InChI=1S/C13H17N3O2S2/c1-2-11-4-3-5-12(8-11)10-20(17,18)16(7-6-14)9-13(15)19/h3-5,8H,2,7,9-10H2,1H3,(H2,15,19)


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