2-[2-[(4-butylphenyl)amino]-4,6-bis(chloranyl)pyrimidin-5-yl]ethanal

Systemtic Name: 2-[2-[(4-butylphenyl)amino]-4,6-bis(chloranyl)pyrimidin-5-yl]ethanal Openeye Name: 2-[2-(4-butylanilino)-4,6-dichloro-pyrimidin-5-yl]acetaldehyde CAS Name: 2-[2-(4-butylanilino)-4,6-dichloro-5-pyrimidinyl]acetaldehyde IUPAC Name: 2-[2-(4-butylanilino)-4,6-dichloropyrimidin-5-yl]acetaldehyde Traditional Name: 2-[2-(4-butylanilino)-4,6-dichloro-pyrimidin-5-yl]acetaldehyde Formula: C16H17Cl2N3O MolecularWeight: 338.23168

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC2=NC(=C(C(=N2)Cl)CC=O)Cl

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC2=NC(=C(C(=N2)Cl)CC=O)Cl

InChI

InChI=1S/C16H17Cl2N3O/c1-2-3-4-11-5-7-12(8-6-11)19-16-20-14(17)13(9-10-22)15(18)21-16/h5-8,10H,2-4,9H2,1H3,(H,19,20,21)