5-(2-chlorophenyl)-4-(3,4-dimethoxyphenyl)pyrrolo[3,2-d]pyrimidine-7-carbonitrile

Systemtic Name: 5-(2-chlorophenyl)-4-(3,4-dimethoxyphenyl)pyrrolo[3,2-d]pyrimidine-7-carbonitrile Openeye Name: 5-(2-chlorophenyl)-4-(3,4-dimethoxyphenyl)pyrrolo[3,2-d]pyrimidine-7-carbonitrile CAS Name: 5-(2-chlorophenyl)-4-(3,4-dimethoxyphenyl)-7-pyrrolo[3,2-d]pyrimidinecarbonitrile IUPAC Name: 5-(2-chlorophenyl)-4-(3,4-dimethoxyphenyl)pyrrolo[3,2-d]pyrimidine-7-carbonitrile Traditional Name: 5-(2-chlorophenyl)-4-(3,4-dimethoxyphenyl)pyrrolo[3,2-d]pyrimidine-7-carbonitrile Formula: C21H15ClN4O2 MolecularWeight: 390.8224

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC=NC3=C2N(C=C3C#N)C4=CC=CC=C4Cl)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC=NC3=C2N(C=C3C#N)C4=CC=CC=C4Cl)OC

InChI

InChI=1S/C21H15ClN4O2/c1-27-17-8-7-13(9-18(17)28-2)19-21-20(25-12-24-19)14(10-23)11-26(21)16-6-4-3-5-15(16)22/h3-9,11-12H,1-2H3