5-(2-methoxyethyl)-3-[2-(3-methoxyphenyl)-2-oxidanylidene-ethyl]-4-oxidanylidene-6-piperazin-1-yl-pyrrolo[3,2-d]pyrimidine-7-carbonitrile

Systemtic Name: 5-(2-methoxyethyl)-3-[2-(3-methoxyphenyl)-2-oxidanylidene-ethyl]-4-oxidanylidene-6-piperazin-1-yl-pyrrolo[3,2-d]pyrimidine-7-carbonitrile Openeye Name: 5-(2-methoxyethyl)-3-[2-(3-methoxyphenyl)-2-oxo-ethyl]-4-oxo-6-piperazin-1-yl-pyrrolo[3,2-d]pyrimidine-7-carbonitrile CAS Name: 5-(2-methoxyethyl)-3-[2-(3-methoxyphenyl)-2-oxoethyl]-4-oxo-6-(1-piperazinyl)-7-pyrrolo[3,2-d]pyrimidinecarbonitrile IUPAC Name: 5-(2-methoxyethyl)-3-[2-(3-methoxyphenyl)-2-oxoethyl]-4-oxo-6-piperazin-1-ylpyrrolo[3,2-d]pyrimidine-7-carbonitrile Traditional Name: 4-keto-3-[2-keto-2-(3-methoxyphenyl)ethyl]-5-(2-methoxyethyl)-6-piperazino-pyrrolo[3,2-d]pyrimidine-7-carbonitrile Formula: C23H26N6O4 MolecularWeight: 450.49034

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C2=C(C(=C1N3CCNCC3)C#N)N=CN(C2=O)CC(=O)C4=CC(=CC=C4)OC

Isomeric SMILES

COCCN1C2=C(C(=C1N3CCNCC3)C#N)N=CN(C2=O)CC(=O)C4=CC(=CC=C4)OC

InChI

InChI=1S/C23H26N6O4/c1-32-11-10-29-21-20(18(13-24)22(29)27-8-6-25-7-9-27)26-15-28(23(21)31)14-19(30)16-4-3-5-17(12-16)33-2/h3-5,12,15,25H,6-11,14H2,1-2H3