7-(3-chloranyl-4-methyl-phenyl)-4-[4-[2-(cyclohexen-1-yl)ethyl]piperazin-1-yl]-5-phenyl-pyrrolo[2,3-d]pyrimidine

Systemtic Name: 7-(3-chloranyl-4-methyl-phenyl)-4-[4-[2-(cyclohexen-1-yl)ethyl]piperazin-1-yl]-5-phenyl-pyrrolo[2,3-d]pyrimidine Openeye Name: 7-(3-chloro-4-methyl-phenyl)-4-[4-[2-(cyclohexen-1-yl)ethyl]piperazin-1-yl]-5-phenyl-pyrrolo[2,3-d]pyrimidine CAS Name: 7-(3-chloro-4-methylphenyl)-4-[4-[2-(1-cyclohexenyl)ethyl]-1-piperazinyl]-5-phenylpyrrolo[2,3-d]pyrimidine IUPAC Name: 7-(3-chloro-4-methylphenyl)-4-[4-[2-(cyclohexen-1-yl)ethyl]piperazin-1-yl]-5-phenylpyrrolo[2,3-d]pyrimidine Traditional Name: 7-(3-chloro-4-methyl-phenyl)-4-[4-[2-(cyclohexen-1-yl)ethyl]piperazino]-5-phenyl-pyrrolo[2,3-d]pyrimidine Formula: C31H34ClN5 MolecularWeight: 512.08816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C=C(C3=C2N=CN=C3N4CCN(CC4)CCC5=CCCCC5)C6=CC=CC=C6)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2C=C(C3=C2N=CN=C3N4CCN(CC4)CCC5=CCCCC5)C6=CC=CC=C6)Cl

InChI

InChI=1S/C31H34ClN5/c1-23-12-13-26(20-28(23)32)37-21-27(25-10-6-3-7-11-25)29-30(33-22-34-31(29)37)36-18-16-35(17-19-36)15-14-24-8-4-2-5-9-24/h3,6-8,10-13,20-22H,2,4-5,9,14-19H2,1H3