6-[(4-chlorophenyl)methyl]-7-cyclohexyl-pyrrolo[2,3-d]pyrimidine-2-carbonitrile

Systemtic Name: 6-[(4-chlorophenyl)methyl]-7-cyclohexyl-pyrrolo[2,3-d]pyrimidine-2-carbonitrile Openeye Name: 6-[(4-chlorophenyl)methyl]-7-cyclohexyl-pyrrolo[2,3-d]pyrimidine-2-carbonitrile CAS Name: 6-[(4-chlorophenyl)methyl]-7-cyclohexyl-2-pyrrolo[2,3-d]pyrimidinecarbonitrile IUPAC Name: 6-[(4-chlorophenyl)methyl]-7-cyclohexylpyrrolo[2,3-d]pyrimidine-2-carbonitrile Traditional Name: 6-(4-chlorobenzyl)-7-cyclohexyl-pyrrolo[2,3-d]pyrimidine-2-carbonitrile Formula: C20H19ClN4 MolecularWeight: 350.84466

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=CC3=CN=C(N=C32)C#N)CC4=CC=C(C=C4)Cl

Isomeric SMILES

C1CCC(CC1)N2C(=CC3=CN=C(N=C32)C#N)CC4=CC=C(C=C4)Cl

InChI

InChI=1S/C20H19ClN4/c21-16-8-6-14(7-9-16)10-18-11-15-13-23-19(12-22)24-20(15)25(18)17-4-2-1-3-5-17/h6-9,11,13,17H,1-5,10H2