2-methyl-3-oxidanylidene-1,4-thiazepane-4-carbaldehyde

Systemtic Name: 2-methyl-3-oxidanylidene-1,4-thiazepane-4-carbaldehyde Openeye Name: 2-methyl-3-oxo-1,4-thiazepane-4-carbaldehyde CAS Name: 2-methyl-3-oxo-1,4-thiazepane-4-carboxaldehyde IUPAC Name: 2-methyl-3-oxo-1,4-thiazepane-4-carbaldehyde Traditional Name: 3-keto-2-methyl-1,4-thiazepane-4-carbaldehyde Formula: C7H11NO2S MolecularWeight: 173.23274

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(CCCS1)C=O

Isomeric SMILES

CC1C(=O)N(CCCS1)C=O

InChI

InChI=1S/C7H11NO2S/c1-6-7(10)8(5-9)3-2-4-11-6/h5-6H,2-4H2,1H3