2-[cyclohexyl-[(3-nitrophenyl)methylsulfonyl]amino]ethanethioamide

Systemtic Name: 2-[cyclohexyl-[(3-nitrophenyl)methylsulfonyl]amino]ethanethioamide Openeye Name: 2-[cyclohexyl-[(3-nitrophenyl)methylsulfonyl]amino]thioacetamide CAS Name: 2-[cyclohexyl-[(3-nitrophenyl)methylsulfonyl]amino]ethanethioamide IUPAC Name: 2-[cyclohexyl-[(3-nitrophenyl)methylsulfonyl]amino]ethanethioamide Traditional Name: 2-[cyclohexyl-(3-nitrobenzyl)sulfonyl-amino]thioacetamide Formula: C15H21N3O4S2 MolecularWeight: 371.47494

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N(CC(=S)N)S(=O)(=O)CC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)N(CC(=S)N)S(=O)(=O)CC2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H21N3O4S2/c16-15(23)10-17(13-6-2-1-3-7-13)24(21,22)11-12-5-4-8-14(9-12)18(19)20/h4-5,8-9,13H,1-3,6-7,10-11H2,(H2,16,23)