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

Systemtic Name: 5-[(butan-2-ylamino)methylidene]-1-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 1-allyl-5-[(sec-butylamino)methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[(butan-2-ylamino)methylidene]-1-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[(butan-2-ylamino)methylidene]-1-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 1-allyl-5-[(sec-butylamino)methylene]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C12H17N3O2S MolecularWeight: 267.34728

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC=C1C(=O)NC(=S)N(C1=O)CC=C

Isomeric SMILES

CCC(C)NC=C1C(=O)NC(=S)N(C1=O)CC=C

InChI

InChI=1S/C12H17N3O2S/c1-4-6-15-11(17)9(7-13-8(3)5-2)10(16)14-12(15)18/h4,7-8,13H,1,5-6H2,2-3H3,(H,14,16,18)