4-[[5-azanylidene-1-phenyl-3-(trifluoromethyl)pyrazol-4-ylidene]amino]-6-methoxy-benzene-1,3-diamine

Systemtic Name: 4-[[5-azanylidene-1-phenyl-3-(trifluoromethyl)pyrazol-4-ylidene]amino]-6-methoxy-benzene-1,3-diamine Openeye Name: 4-[[5-imino-1-phenyl-3-(trifluoromethyl)pyrazol-4-ylidene]amino]-6-methoxy-benzene-1,3-diamine CAS Name: 4-[[5-imino-1-phenyl-3-(trifluoromethyl)-4-pyrazolylidene]amino]-6-methoxybenzene-1,3-diamine IUPAC Name: 4-[[5-imino-1-phenyl-3-(trifluoromethyl)pyrazol-4-ylidene]amino]-6-methoxybenzene-1,3-diamine Traditional Name: [5-amino-2-[[5-imino-1-phenyl-3-(trifluoromethyl)-2-pyrazolin-4-ylidene]amino]-4-methoxy-phenyl]amine Formula: C17H15F3N6O MolecularWeight: 376.33581

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)N=C2C(=NN(C2=N)C3=CC=CC=C3)C(F)(F)F)N)N

Isomeric SMILES

COC1=C(C=C(C(=C1)N=C2C(=NN(C2=N)C3=CC=CC=C3)C(F)(F)F)N)N

InChI

InChI=1S/C17H15F3N6O/c1-27-13-8-12(10(21)7-11(13)22)24-14-15(17(18,19)20)25-26(16(14)23)9-5-3-2-4-6-9/h2-8,23H,21-22H2,1H3