2-[2-[2-[4,6-bis[[3,5-bis(chloranyl)phenyl]methylamino]-1,3,5-triazin-2-yl]hydrazinyl]-1-methyl-6-oxidanylidene-4-phenyl-pyrimidin-5-yl]ethanenitrile

Systemtic Name: 2-[2-[2-[4,6-bis[[3,5-bis(chloranyl)phenyl]methylamino]-1,3,5-triazin-2-yl]hydrazinyl]-1-methyl-6-oxidanylidene-4-phenyl-pyrimidin-5-yl]ethanenitrile Openeye Name: 2-[2-[2-[4,6-bis[(3,5-dichlorophenyl)methylamino]-1,3,5-triazin-2-yl]hydrazino]-1-methyl-6-oxo-4-phenyl-pyrimidin-5-yl]acetonitrile CAS Name: 2-[2-[[4,6-bis[(3,5-dichlorophenyl)methylamino]-1,3,5-triazin-2-yl]hydrazo]-1-methyl-6-oxo-4-phenyl-5-pyrimidinyl]acetonitrile IUPAC Name: 2-[2-[2-[4,6-bis[(3,5-dichlorophenyl)methylamino]-1,3,5-triazin-2-yl]hydrazinyl]-1-methyl-6-oxo-4-phenylpyrimidin-5-yl]acetonitrile Traditional Name: 2-[2-[N'-[4,6-bis[(3,5-dichlorobenzyl)amino]-s-triazin-2-yl]hydrazino]-6-keto-1-methyl-4-phenyl-pyrimidin-5-yl]acetonitrile Formula: C30H24Cl4N10O MolecularWeight: 682.38996

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=C(N=C1NNC2=NC(=NC(=N2)NCC3=CC(=CC(=C3)Cl)Cl)NCC4=CC(=CC(=C4)Cl)Cl)C5=CC=CC=C5)CC#N

Isomeric SMILES

CN1C(=O)C(=C(N=C1NNC2=NC(=NC(=N2)NCC3=CC(=CC(=C3)Cl)Cl)NCC4=CC(=CC(=C4)Cl)Cl)C5=CC=CC=C5)CC#N

InChI

InChI=1S/C30H24Cl4N10O/c1-44-26(45)24(7-8-35)25(19-5-3-2-4-6-19)38-30(44)43-42-29-40-27(36-15-17-9-20(31)13-21(32)10-17)39-28(41-29)37-16-18-11-22(33)14-23(34)12-18/h2-6,9-14H,7,15-16H2,1H3,(H,38,43)(H3,36,37,39,40,41,42)