2-[3-[(2-chlorophenyl)methylcarbamoylamino]thiophen-2-yl]-1-methyl-5,6-bis(oxidanylidene)-4H-pyrimidine-4-carboxylic acid

Systemtic Name: 2-[3-[(2-chlorophenyl)methylcarbamoylamino]thiophen-2-yl]-1-methyl-5,6-bis(oxidanylidene)-4H-pyrimidine-4-carboxylic acid Openeye Name: 2-[3-[(2-chlorophenyl)methylcarbamoylamino]-2-thienyl]-1-methyl-5,6-dioxo-4H-pyrimidine-4-carboxylic acid CAS Name: 2-[3-[[[(2-chlorophenyl)methylamino]-oxomethyl]amino]-2-thiophenyl]-1-methyl-5,6-dioxo-4H-pyrimidine-4-carboxylic acid IUPAC Name: 2-[3-[(2-chlorophenyl)methylcarbamoylamino]thiophen-2-yl]-1-methyl-5,6-dioxo-4H-pyrimidine-4-carboxylic acid Traditional Name: 2-[3-[(2-chlorobenzyl)carbamoylamino]-2-thienyl]-5,6-diketo-1-methyl-4H-pyrimidine-4-carboxylic acid Formula: C18H15ClN4O5S MolecularWeight: 434.8535

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC(C(=O)C1=O)C(=O)O)C2=C(C=CS2)NC(=O)NCC3=CC=CC=C3Cl

Isomeric SMILES

CN1C(=NC(C(=O)C1=O)C(=O)O)C2=C(C=CS2)NC(=O)NCC3=CC=CC=C3Cl

InChI

InChI=1S/C18H15ClN4O5S/c1-23-15(22-12(17(26)27)13(24)16(23)25)14-11(6-7-29-14)21-18(28)20-8-9-4-2-3-5-10(9)19/h2-7,12H,8H2,1H3,(H,26,27)(H2,20,21,28)