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

Systemtic Name: 5-(3-chlorophenyl)-4-(4-methoxyphenyl)pyrrolo[3,2-d]pyrimidine-7-carbonitrile Openeye Name: 5-(3-chlorophenyl)-4-(4-methoxyphenyl)pyrrolo[3,2-d]pyrimidine-7-carbonitrile CAS Name: 5-(3-chlorophenyl)-4-(4-methoxyphenyl)-7-pyrrolo[3,2-d]pyrimidinecarbonitrile IUPAC Name: 5-(3-chlorophenyl)-4-(4-methoxyphenyl)pyrrolo[3,2-d]pyrimidine-7-carbonitrile Traditional Name: 5-(3-chlorophenyl)-4-(4-methoxyphenyl)pyrrolo[3,2-d]pyrimidine-7-carbonitrile Formula: C20H13ClN4O MolecularWeight: 360.79642

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H13ClN4O/c1-26-17-7-5-13(6-8-17)18-20-19(24-12-23-18)14(10-22)11-25(20)16-4-2-3-15(21)9-16/h2-9,11-12H,1H3