S-[(3-nitro-5,6,7,8-tetrahydronaphthalen-1-yl)] N-(dimethylamino)carbamothioate

Systemtic Name: S-[(3-nitro-5,6,7,8-tetrahydronaphthalen-1-yl)] N-(dimethylamino)carbamothioate Openeye Name: S-(7-nitrotetralin-5-yl) N-(dimethylamino)carbamothioate CAS Name: N-(dimethylamino)carbamothioic acid S-[(3-nitro-5,6,7,8-tetrahydronaphthalen-1-yl)] ester IUPAC Name: S-[(3-nitro-5,6,7,8-tetrahydronaphthalen-1-yl)] N-(dimethylamino)carbamothioate Traditional Name: N-(dimethylamino)thiocarbamic acid S-(7-nitrotetralin-5-yl) ester Formula: C13H17N3O3S MolecularWeight: 295.35738

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)NC(=O)SC1=C2CCCCC2=CC(=C1)[N+](=O)[O-]

Isomeric SMILES

CN(C)NC(=O)SC1=C2CCCCC2=CC(=C1)[N+](=O)[O-]

InChI

InChI=1S/C13H17N3O3S/c1-15(2)14-13(17)20-12-8-10(16(18)19)7-9-5-3-4-6-11(9)12/h7-8H,3-6H2,1-2H3,(H,14,17)