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

Systemtic Name: 6-[(4-chlorophenyl)methyl]-7-(cyclohexylmethyl)pyrrolo[2,3-d]pyrimidine-2-carbonitrile Openeye Name: 6-[(4-chlorophenyl)methyl]-7-(cyclohexylmethyl)pyrrolo[2,3-d]pyrimidine-2-carbonitrile CAS Name: 6-[(4-chlorophenyl)methyl]-7-(cyclohexylmethyl)-2-pyrrolo[2,3-d]pyrimidinecarbonitrile IUPAC Name: 6-[(4-chlorophenyl)methyl]-7-(cyclohexylmethyl)pyrrolo[2,3-d]pyrimidine-2-carbonitrile Traditional Name: 6-(4-chlorobenzyl)-7-(cyclohexylmethyl)pyrrolo[2,3-d]pyrimidine-2-carbonitrile Formula: C21H21ClN4 MolecularWeight: 364.87124

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CN2C(=CC3=CN=C(N=C32)C#N)CC4=CC=C(C=C4)Cl

Isomeric SMILES

C1CCC(CC1)CN2C(=CC3=CN=C(N=C32)C#N)CC4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H21ClN4/c22-18-8-6-15(7-9-18)10-19-11-17-13-24-20(12-23)25-21(17)26(19)14-16-4-2-1-3-5-16/h6-9,11,13,16H,1-5,10,14H2