4-[2-(5-chloranylthiophen-2-yl)ethylamino]-1,3-dimethyl-2,6-bis(oxidanylidene)pyrimidine-5-carbonitrile

Systemtic Name: 4-[2-(5-chloranylthiophen-2-yl)ethylamino]-1,3-dimethyl-2,6-bis(oxidanylidene)pyrimidine-5-carbonitrile Openeye Name: 4-[2-(5-chloro-2-thienyl)ethylamino]-1,3-dimethyl-2,6-dioxo-pyrimidine-5-carbonitrile CAS Name: 4-[2-(5-chloro-2-thiophenyl)ethylamino]-1,3-dimethyl-2,6-dioxo-5-pyrimidinecarbonitrile IUPAC Name: 4-[2-(5-chlorothiophen-2-yl)ethylamino]-1,3-dimethyl-2,6-dioxopyrimidine-5-carbonitrile Traditional Name: 4-[2-(5-chloro-2-thienyl)ethylamino]-2,6-diketo-1,3-dimethyl-pyrimidine-5-carbonitrile Formula: C13H13ClN4O2S MolecularWeight: 324.78592

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=O)N(C1=O)C)C#N)NCCC2=CC=C(S2)Cl

Isomeric SMILES

CN1C(=C(C(=O)N(C1=O)C)C#N)NCCC2=CC=C(S2)Cl

InChI

InChI=1S/C13H13ClN4O2S/c1-17-11(9(7-15)12(19)18(2)13(17)20)16-6-5-8-3-4-10(14)21-8/h3-4,16H,5-6H2,1-2H3