1-(1,3-benzodioxol-5-yl)-3-(3-chlorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-(3-chlorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 1-(1,3-benzodioxol-5-yl)-3-(3-chlorophenyl)-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 1-(1,3-benzodioxol-5-yl)-3-(3-chlorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-(3-chlorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 1-(1,3-benzodioxol-5-yl)-3-(3-chlorophenyl)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C17H11ClN2O4S MolecularWeight: 374.79824

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C(=S)N(C1=O)C2=CC3=C(C=C2)OCO3)C4=CC(=CC=C4)Cl

Isomeric SMILES

C1C(=O)N(C(=S)N(C1=O)C2=CC3=C(C=C2)OCO3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C17H11ClN2O4S/c18-10-2-1-3-11(6-10)19-15(21)8-16(22)20(17(19)25)12-4-5-13-14(7-12)24-9-23-13/h1-7H,8-9H2