N-[1,1-bis(oxidanylidene)thiolan-3-yl]-2-[(2-chloranyl-5-nitro-phenyl)methyl-methyl-amino]-N-methyl-ethanamide

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-2-[(2-chloranyl-5-nitro-phenyl)methyl-methyl-amino]-N-methyl-ethanamide Openeye Name: 2-[(2-chloro-5-nitro-phenyl)methyl-methyl-amino]-N-(1,1-dioxothiolan-3-yl)-N-methyl-acetamide CAS Name: 2-[(2-chloro-5-nitrophenyl)methyl-methylamino]-N-(1,1-dioxo-3-thiolanyl)-N-methylacetamide IUPAC Name: 2-[(2-chloro-5-nitrophenyl)methyl-methylamino]-N-(1,1-dioxothiolan-3-yl)-N-methylacetamide Traditional Name: 2-[(2-chloro-5-nitro-benzyl)-methyl-amino]-N-(1,1-diketothiolan-3-yl)-N-methyl-acetamide Formula: C15H20ClN3O5S MolecularWeight: 389.8544

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(C=CC(=C1)[N+](=O)[O-])Cl)CC(=O)N(C)C2CCS(=O)(=O)C2

Isomeric SMILES

CN(CC1=C(C=CC(=C1)[N+](=O)[O-])Cl)CC(=O)N(C)C2CCS(=O)(=O)C2

InChI

InChI=1S/C15H20ClN3O5S/c1-17(8-11-7-12(19(21)22)3-4-14(11)16)9-15(20)18(2)13-5-6-25(23,24)10-13/h3-4,7,13H,5-6,8-10H2,1-2H3