4-(4-chlorophenyl)-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperidine-4-carbonitrile

Systemtic Name: 4-(4-chlorophenyl)-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperidine-4-carbonitrile Openeye Name: 4-(4-chlorophenyl)-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperidine-4-carbonitrile CAS Name: 4-(4-chlorophenyl)-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-4-piperidinecarbonitrile IUPAC Name: 4-(4-chlorophenyl)-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperidine-4-carbonitrile Traditional Name: 4-(4-chlorophenyl)-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)isonipecotonitrile Formula: C18H16ClN5 MolecularWeight: 337.80614

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C#N)C2=CC=C(C=C2)Cl)C3=NC=NC4=C3C=CN4

Isomeric SMILES

C1CN(CCC1(C#N)C2=CC=C(C=C2)Cl)C3=NC=NC4=C3C=CN4

InChI

InChI=1S/C18H16ClN5/c19-14-3-1-13(2-4-14)18(11-20)6-9-24(10-7-18)17-15-5-8-21-16(15)22-12-23-17/h1-5,8,12H,6-7,9-10H2,(H,21,22,23)