6-(3,4-dichlorophenyl)-2-pyrrolidin-1-yl-5-sulfanylidene-1H-pyrimido[4,5-d]pyrimidin-4-one

Systemtic Name: 6-(3,4-dichlorophenyl)-2-pyrrolidin-1-yl-5-sulfanylidene-1H-pyrimido[4,5-d]pyrimidin-4-one Openeye Name: 6-(3,4-dichlorophenyl)-2-pyrrolidin-1-yl-5-thioxo-1H-pyrimido[4,5-d]pyrimidin-4-one CAS Name: 6-(3,4-dichlorophenyl)-2-(1-pyrrolidinyl)-5-sulfanylidene-1H-pyrimido[4,5-d]pyrimidin-4-one IUPAC Name: 6-(3,4-dichlorophenyl)-2-pyrrolidin-1-yl-5-sulfanylidene-1H-pyrimido[4,5-d]pyrimidin-4-one Traditional Name: 6-(3,4-dichlorophenyl)-2-pyrrolidino-5-thioxo-1H-pyrimido[4,5-d]pyrimidin-4-one Formula: C16H13Cl2N5OS MolecularWeight: 394.27832

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NC(=O)C3=C(N2)N=CN(C3=S)C4=CC(=C(C=C4)Cl)Cl

Isomeric SMILES

C1CCN(C1)C2=NC(=O)C3=C(N2)N=CN(C3=S)C4=CC(=C(C=C4)Cl)Cl

InChI

InChI=1S/C16H13Cl2N5OS/c17-10-4-3-9(7-11(10)18)23-8-19-13-12(15(23)25)14(24)21-16(20-13)22-5-1-2-6-22/h3-4,7-8H,1-2,5-6H2,(H,20,21,24)