N-[(4-chlorophenyl)methyl]-5-(1H-pyrrolo[2,3-b]pyridin-3-ylmethyl)pyrimidin-2-amine

Systemtic Name: N-[(4-chlorophenyl)methyl]-5-(1H-pyrrolo[2,3-b]pyridin-3-ylmethyl)pyrimidin-2-amine Openeye Name: N-[(4-chlorophenyl)methyl]-5-(1H-pyrrolo[2,3-b]pyridin-3-ylmethyl)pyrimidin-2-amine CAS Name: N-[(4-chlorophenyl)methyl]-5-(1H-pyrrolo[2,3-b]pyridin-3-ylmethyl)-2-pyrimidinamine IUPAC Name: N-[(4-chlorophenyl)methyl]-5-(1H-pyrrolo[2,3-b]pyridin-3-ylmethyl)pyrimidin-2-amine Traditional Name: (4-chlorobenzyl)-[5-(1H-pyrrolo[2,3-b]pyridin-3-ylmethyl)pyrimidin-2-yl]amine Formula: C19H16ClN5 MolecularWeight: 349.81684

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(NC=C2CC3=CN=C(N=C3)NCC4=CC=C(C=C4)Cl)N=C1

Isomeric SMILES

C1=CC2=C(NC=C2CC3=CN=C(N=C3)NCC4=CC=C(C=C4)Cl)N=C1

InChI

InChI=1S/C19H16ClN5/c20-16-5-3-13(4-6-16)9-23-19-24-10-14(11-25-19)8-15-12-22-18-17(15)2-1-7-21-18/h1-7,10-12H,8-9H2,(H,21,22)(H,23,24,25)