1-(3-chloranyl-4-fluoranyl-phenyl)-5-(piperidin-1-ylmethylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 1-(3-chloranyl-4-fluoranyl-phenyl)-5-(piperidin-1-ylmethylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 1-(3-chloro-4-fluoro-phenyl)-5-(1-piperidylmethylene)-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 1-(3-chloro-4-fluorophenyl)-5-(1-piperidinylmethylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 1-(3-chloro-4-fluorophenyl)-5-(piperidin-1-ylmethylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 1-(3-chloro-4-fluoro-phenyl)-5-(piperidinomethylene)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C16H15ClFN3O2S MolecularWeight: 367.825603

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C=C2C(=O)NC(=S)N(C2=O)C3=CC(=C(C=C3)F)Cl

Isomeric SMILES

C1CCN(CC1)C=C2C(=O)NC(=S)N(C2=O)C3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C16H15ClFN3O2S/c17-12-8-10(4-5-13(12)18)21-15(23)11(14(22)19-16(21)24)9-20-6-2-1-3-7-20/h4-5,8-9H,1-3,6-7H2,(H,19,22,24)