N-[1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)ethyl]-3-iodanyl-aniline

Systemtic Name: N-[1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)ethyl]-3-iodanyl-aniline Openeye Name: N-[1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)ethyl]-3-iodo-aniline CAS Name: N-[1-(2,7-dimethyl-6-pyrazolo[1,5-a]pyrimidinyl)ethyl]-3-iodoaniline IUPAC Name: N-[1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)ethyl]-3-iodoaniline Traditional Name: 1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)ethyl-(3-iodophenyl)amine Formula: C16H17IN4 MolecularWeight: 392.23745

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN2C(=C(C=NC2=C1)C(C)NC3=CC(=CC=C3)I)C

Isomeric SMILES

CC1=NN2C(=C(C=NC2=C1)C(C)NC3=CC(=CC=C3)I)C

InChI

InChI=1S/C16H17IN4/c1-10-7-16-18-9-15(12(3)21(16)20-10)11(2)19-14-6-4-5-13(17)8-14/h4-9,11,19H,1-3H3