3-(4-chlorophenyl)-7-[(2-ethylphenyl)carbamoyl]-5-methyl-4-oxidanylidene-pyrrolo[3,2-d]pyrimidin-2-olate

Systemtic Name: 3-(4-chlorophenyl)-7-[(2-ethylphenyl)carbamoyl]-5-methyl-4-oxidanylidene-pyrrolo[3,2-d]pyrimidin-2-olate Openeye Name: 3-(4-chlorophenyl)-7-[(2-ethylphenyl)carbamoyl]-5-methyl-4-oxo-pyrrolo[3,2-d]pyrimidin-2-olate CAS Name: 3-(4-chlorophenyl)-7-[(2-ethylanilino)-oxomethyl]-5-methyl-4-oxo-2-pyrrolo[3,2-d]pyrimidinolate IUPAC Name: 3-(4-chlorophenyl)-7-[(2-ethylphenyl)carbamoyl]-5-methyl-4-oxopyrrolo[3,2-d]pyrimidin-2-olate Traditional Name: 3-(4-chlorophenyl)-7-[(2-ethylphenyl)carbamoyl]-4-keto-5-methyl-pyrrolo[3,2-d]pyrimidin-2-olate Formula: C22H18ClN4O3- MolecularWeight: 421.85632

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)C2=CN(C3=C2N=C(N(C3=O)C4=CC=C(C=C4)Cl)[O-])C

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)C2=CN(C3=C2N=C(N(C3=O)C4=CC=C(C=C4)Cl)[O-])C

InChI

InChI=1S/C22H19ClN4O3/c1-3-13-6-4-5-7-17(13)24-20(28)16-12-26(2)19-18(16)25-22(30)27(21(19)29)15-10-8-14(23)9-11-15/h4-12H,3H2,1-2H3,(H,24,28)(H,25,30)/p-1