2-[(3-chlorophenyl)methylsulfonyl-prop-2-enyl-amino]ethanethioamide

Systemtic Name: 2-[(3-chlorophenyl)methylsulfonyl-prop-2-enyl-amino]ethanethioamide Openeye Name: 2-[allyl-[(3-chlorophenyl)methylsulfonyl]amino]thioacetamide CAS Name: 2-[(3-chlorophenyl)methylsulfonyl-prop-2-enylamino]ethanethioamide IUPAC Name: 2-[(3-chlorophenyl)methylsulfonyl-prop-2-enylamino]ethanethioamide Traditional Name: 2-[allyl-(3-chlorobenzyl)sulfonyl-amino]thioacetamide Formula: C12H15ClN2O2S2 MolecularWeight: 318.8427

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN(CC(=S)N)S(=O)(=O)CC1=CC(=CC=C1)Cl

Isomeric SMILES

C=CCN(CC(=S)N)S(=O)(=O)CC1=CC(=CC=C1)Cl

InChI

InChI=1S/C12H15ClN2O2S2/c1-2-6-15(8-12(14)18)19(16,17)9-10-4-3-5-11(13)7-10/h2-5,7H,1,6,8-9H2,(H2,14,18)