4-[4-[1,1-bis(oxidanylidene)-1,2-thiazinan-2-yl]-2-chloranyl-phenyl]carbonylpiperazine-1-carbaldehyde

Systemtic Name: 4-[4-[1,1-bis(oxidanylidene)-1,2-thiazinan-2-yl]-2-chloranyl-phenyl]carbonylpiperazine-1-carbaldehyde Openeye Name: 4-[2-chloro-4-(1,1-dioxothiazinan-2-yl)benzoyl]piperazine-1-carbaldehyde CAS Name: 4-[[2-chloro-4-(1,1-dioxo-2-thiazinanyl)phenyl]-oxomethyl]-1-piperazinecarboxaldehyde IUPAC Name: 4-[2-chloro-4-(1,1-dioxothiazinan-2-yl)benzoyl]piperazine-1-carbaldehyde Traditional Name: 4-[2-chloro-4-(1,1-diketothiazinan-2-yl)benzoyl]piperazine-1-carbaldehyde Formula: C16H20ClN3O4S MolecularWeight: 385.8657

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Descriptors Computed from Structure

Canonical SMILES:

C1CCS(=O)(=O)N(C1)C2=CC(=C(C=C2)C(=O)N3CCN(CC3)C=O)Cl

Isomeric SMILES

C1CCS(=O)(=O)N(C1)C2=CC(=C(C=C2)C(=O)N3CCN(CC3)C=O)Cl

InChI

InChI=1S/C16H20ClN3O4S/c17-15-11-13(20-5-1-2-10-25(20,23)24)3-4-14(15)16(22)19-8-6-18(12-21)7-9-19/h3-4,11-12H,1-2,5-10H2