N-(3-azanyl-3-sulfanylidene-propyl)-2-[2,7-bis(oxidanylidene)azepan-1-yl]-N-methyl-ethanamide

Systemtic Name: N-(3-azanyl-3-sulfanylidene-propyl)-2-[2,7-bis(oxidanylidene)azepan-1-yl]-N-methyl-ethanamide Openeye Name: N-(3-amino-3-thioxo-propyl)-2-(2,7-dioxoazepan-1-yl)-N-methyl-acetamide CAS Name: N-(3-amino-3-sulfanylidenepropyl)-2-(2,7-dioxo-1-azepanyl)-N-methylacetamide IUPAC Name: N-(3-amino-3-sulfanylidenepropyl)-2-(2,7-dioxoazepan-1-yl)-N-methylacetamide Traditional Name: N-(3-amino-3-thioxo-propyl)-2-(2,7-diketoazepan-1-yl)-N-methyl-acetamide Formula: C12H19N3O3S MolecularWeight: 285.36256

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC(=S)N)C(=O)CN1C(=O)CCCCC1=O

Isomeric SMILES

CN(CCC(=S)N)C(=O)CN1C(=O)CCCCC1=O

InChI

InChI=1S/C12H19N3O3S/c1-14(7-6-9(13)19)12(18)8-15-10(16)4-2-3-5-11(15)17/h2-8H2,1H3,(H2,13,19)