5-[(azepan-1-ylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-[(azepan-1-ylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[(azepan-1-ylamino)methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[(1-azepanylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[(azepan-1-ylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[(azepan-1-ylamino)methylene]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C11H16N4O2S MolecularWeight: 268.33534

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)NC=C2C(=O)NC(=S)NC2=O

Isomeric SMILES

C1CCCN(CC1)NC=C2C(=O)NC(=S)NC2=O

InChI

InChI=1S/C11H16N4O2S/c16-9-8(10(17)14-11(18)13-9)7-12-15-5-3-1-2-4-6-15/h7,12H,1-6H2,(H2,13,14,16,17,18)