2-azanyl-4-[3-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]-4-methoxy-phenyl]-5-oxidanylidene-4H-pyrano[3,2-c]chromene-3-carbonitrile

Systemtic Name: 2-azanyl-4-[3-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]-4-methoxy-phenyl]-5-oxidanylidene-4H-pyrano[3,2-c]chromene-3-carbonitrile Openeye Name: 2-amino-4-[3-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]-4-methoxy-phenyl]-5-oxo-4H-pyrano[3,2-c]chromene-3-carbonitrile CAS Name: 2-amino-4-[3-[(4-bromo-3,5-dimethyl-1-pyrazolyl)methyl]-4-methoxyphenyl]-5-oxo-4H-pyrano[3,2-c][1]benzopyran-3-carbonitrile IUPAC Name: 2-amino-4-[3-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-4-methoxyphenyl]-5-oxo-4H-pyrano[3,2-c]chromene-3-carbonitrile Traditional Name: 2-amino-4-[3-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]-4-methoxy-phenyl]-5-keto-4H-pyrano[3,2-c]chromene-3-carbonitrile Formula: C26H21BrN4O4 MolecularWeight: 533.37334

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=C(C=CC(=C2)C3C(=C(OC4=C3C(=O)OC5=CC=CC=C54)N)C#N)OC)C)Br

Isomeric SMILES

CC1=C(C(=NN1CC2=C(C=CC(=C2)C3C(=C(OC4=C3C(=O)OC5=CC=CC=C54)N)C#N)OC)C)Br

InChI

InChI=1S/C26H21BrN4O4/c1-13-23(27)14(2)31(30-13)12-16-10-15(8-9-19(16)33-3)21-18(11-28)25(29)35-24-17-6-4-5-7-20(17)34-26(32)22(21)24/h4-10,21H,12,29H2,1-3H3