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

Systemtic Name: 2-[cyanomethyl-[(3-propoxyphenyl)methylsulfonyl]amino]ethanethioamide Openeye Name: 2-[cyanomethyl-[(3-propoxyphenyl)methylsulfonyl]amino]thioacetamide CAS Name: 2-[cyanomethyl-[(3-propoxyphenyl)methylsulfonyl]amino]ethanethioamide IUPAC Name: 2-[cyanomethyl-[(3-propoxyphenyl)methylsulfonyl]amino]ethanethioamide Traditional Name: 2-[cyanomethyl-(3-propoxybenzyl)sulfonyl-amino]thioacetamide Formula: C14H19N3O3S2 MolecularWeight: 341.44896

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC(=C1)CS(=O)(=O)N(CC#N)CC(=S)N

Isomeric SMILES

CCCOC1=CC=CC(=C1)CS(=O)(=O)N(CC#N)CC(=S)N

InChI

InChI=1S/C14H19N3O3S2/c1-2-8-20-13-5-3-4-12(9-13)11-22(18,19)17(7-6-15)10-14(16)21/h3-5,9H,2,7-8,10-11H2,1H3,(H2,16,21)