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

Systemtic Name: N-(3-azanyl-3-sulfanylidene-propyl)-3-[2,7-bis(oxidanylidene)azepan-1-yl]-N-methyl-propanamide Openeye Name: N-(3-amino-3-thioxo-propyl)-3-(2,7-dioxoazepan-1-yl)-N-methyl-propanamide CAS Name: N-(3-amino-3-sulfanylidenepropyl)-3-(2,7-dioxo-1-azepanyl)-N-methylpropanamide IUPAC Name: N-(3-amino-3-sulfanylidenepropyl)-3-(2,7-dioxoazepan-1-yl)-N-methylpropanamide Traditional Name: N-(3-amino-3-thioxo-propyl)-3-(2,7-diketoazepan-1-yl)-N-methyl-propionamide Formula: C13H21N3O3S MolecularWeight: 299.38914

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC(=S)N)C(=O)CCN1C(=O)CCCCC1=O

Isomeric SMILES

CN(CCC(=S)N)C(=O)CCN1C(=O)CCCCC1=O

InChI

InChI=1S/C13H21N3O3S/c1-15(8-6-10(14)20)11(17)7-9-16-12(18)4-2-3-5-13(16)19/h2-9H2,1H3,(H2,14,20)