2-[2-[[2,3-bis(chloranyl)phenyl]amino]-2-oxidanylidene-ethyl]sulfanyl-3-cyclopentyl-6-oxidanylidene-pyrimidin-4-olate

Systemtic Name: 2-[2-[[2,3-bis(chloranyl)phenyl]amino]-2-oxidanylidene-ethyl]sulfanyl-3-cyclopentyl-6-oxidanylidene-pyrimidin-4-olate Openeye Name: 3-cyclopentyl-2-[2-(2,3-dichloroanilino)-2-oxo-ethyl]sulfanyl-6-oxo-pyrimidin-4-olate CAS Name: 3-cyclopentyl-2-[[2-(2,3-dichloroanilino)-2-oxoethyl]thio]-6-oxo-4-pyrimidinolate IUPAC Name: 3-cyclopentyl-2-[2-(2,3-dichloroanilino)-2-oxoethyl]sulfanyl-6-oxopyrimidin-4-olate Traditional Name: 3-cyclopentyl-2-[[2-(2,3-dichloroanilino)-2-keto-ethyl]thio]-6-keto-pyrimidin-4-olate Formula: C17H16Cl2N3O3S- MolecularWeight: 413.29824

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C(=CC(=O)N=C2SCC(=O)NC3=C(C(=CC=C3)Cl)Cl)[O-]

Isomeric SMILES

C1CCC(C1)N2C(=CC(=O)N=C2SCC(=O)NC3=C(C(=CC=C3)Cl)Cl)[O-]

InChI

InChI=1S/C17H17Cl2N3O3S/c18-11-6-3-7-12(16(11)19)20-14(24)9-26-17-21-13(23)8-15(25)22(17)10-4-1-2-5-10/h3,6-8,10,25H,1-2,4-5,9H2,(H,20,24)/p-1