4-[2-[(4-iodophenyl)amino]pyrimidin-4-yl]-3,5-dimethyl-1H-pyrrole-2-carbonitrile

Systemtic Name: 4-[2-[(4-iodophenyl)amino]pyrimidin-4-yl]-3,5-dimethyl-1H-pyrrole-2-carbonitrile Openeye Name: 4-[2-(4-iodoanilino)pyrimidin-4-yl]-3,5-dimethyl-1H-pyrrole-2-carbonitrile CAS Name: 4-[2-(4-iodoanilino)-4-pyrimidinyl]-3,5-dimethyl-1H-pyrrole-2-carbonitrile IUPAC Name: 4-[2-(4-iodoanilino)pyrimidin-4-yl]-3,5-dimethyl-1H-pyrrole-2-carbonitrile Traditional Name: 4-[2-(4-iodoanilino)pyrimidin-4-yl]-3,5-dimethyl-1H-pyrrole-2-carbonitrile Formula: C17H14IN5 MolecularWeight: 415.23103

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C2=NC(=NC=C2)NC3=CC=C(C=C3)I)C)C#N

Isomeric SMILES

CC1=C(NC(=C1C2=NC(=NC=C2)NC3=CC=C(C=C3)I)C)C#N

InChI

InChI=1S/C17H14IN5/c1-10-15(9-19)21-11(2)16(10)14-7-8-20-17(23-14)22-13-5-3-12(18)4-6-13/h3-8,21H,1-2H3,(H,20,22,23)