5-[(1,3-benzodioxol-5-ylamino)methylidene]-1-[(2S)-butan-2-yl]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-[(1,3-benzodioxol-5-ylamino)methylidene]-1-[(2S)-butan-2-yl]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[(1,3-benzodioxol-5-ylamino)methylene]-1-[(1S)-1-methylpropyl]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[(1,3-benzodioxol-5-ylamino)methylidene]-1-[(2S)-butan-2-yl]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[(1,3-benzodioxol-5-ylamino)methylidene]-1-[(2S)-butan-2-yl]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[(1,3-benzodioxol-5-ylamino)methylene]-1-[(1S)-1-methylpropyl]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C16H17N3O4S MolecularWeight: 347.38888

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C(=O)C(=CNC2=CC3=C(C=C2)OCO3)C(=O)NC1=S

Isomeric SMILES

CC[C@H](C)N1C(=O)C(=CNC2=CC3=C(C=C2)OCO3)C(=O)NC1=S

InChI

InChI=1S/C16H17N3O4S/c1-3-9(2)19-15(21)11(14(20)18-16(19)24)7-17-10-4-5-12-13(6-10)23-8-22-12/h4-7,9,17H,3,8H2,1-2H3,(H,18,20,24)/t9-/m0/s1