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

Systemtic Name: 2-[2-[2-[4,6-bis[(2,4-dimethylphenyl)methylamino]-1,3,5-triazin-2-yl]hydrazinyl]-4-(4-chlorophenyl)-1-methyl-6-oxidanylidene-pyrimidin-5-yl]ethanenitrile Openeye Name: 2-[2-[2-[4,6-bis[(2,4-dimethylphenyl)methylamino]-1,3,5-triazin-2-yl]hydrazino]-4-(4-chlorophenyl)-1-methyl-6-oxo-pyrimidin-5-yl]acetonitrile CAS Name: 2-[2-[[4,6-bis[(2,4-dimethylphenyl)methylamino]-1,3,5-triazin-2-yl]hydrazo]-4-(4-chlorophenyl)-1-methyl-6-oxo-5-pyrimidinyl]acetonitrile IUPAC Name: 2-[2-[2-[4,6-bis[(2,4-dimethylphenyl)methylamino]-1,3,5-triazin-2-yl]hydrazinyl]-4-(4-chlorophenyl)-1-methyl-6-oxopyrimidin-5-yl]acetonitrile Traditional Name: 2-[2-[N'-[4,6-bis[(2,4-dimethylbenzyl)amino]-s-triazin-2-yl]hydrazino]-4-(4-chlorophenyl)-6-keto-1-methyl-pyrimidin-5-yl]acetonitrile Formula: C34H35ClN10O MolecularWeight: 635.1611

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)CNC2=NC(=NC(=N2)NNC3=NC(=C(C(=O)N3C)CC#N)C4=CC=C(C=C4)Cl)NCC5=C(C=C(C=C5)C)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)CNC2=NC(=NC(=N2)NNC3=NC(=C(C(=O)N3C)CC#N)C4=CC=C(C=C4)Cl)NCC5=C(C=C(C=C5)C)C)C

InChI

InChI=1S/C34H35ClN10O/c1-20-6-8-25(22(3)16-20)18-37-31-40-32(38-19-26-9-7-21(2)17-23(26)4)42-33(41-31)43-44-34-39-29(24-10-12-27(35)13-11-24)28(14-15-36)30(46)45(34)5/h6-13,16-17H,14,18-19H2,1-5H3,(H,39,44)(H3,37,38,40,41,42,43)