2-azanyl-4-(5-bromanyl-2-methoxy-phenyl)-7-methyl-6-[(4-methylphenyl)methyl]-5-oxidanylidene-4H-pyrano[3,2-c]pyridine-3-carbonitrile

Systemtic Name: 2-azanyl-4-(5-bromanyl-2-methoxy-phenyl)-7-methyl-6-[(4-methylphenyl)methyl]-5-oxidanylidene-4H-pyrano[3,2-c]pyridine-3-carbonitrile Openeye Name: 2-amino-4-(5-bromo-2-methoxy-phenyl)-7-methyl-5-oxo-6-(p-tolylmethyl)-4H-pyrano[3,2-c]pyridine-3-carbonitrile CAS Name: 2-amino-4-(5-bromo-2-methoxyphenyl)-7-methyl-6-[(4-methylphenyl)methyl]-5-oxo-4H-pyrano[3,2-c]pyridine-3-carbonitrile IUPAC Name: 2-amino-4-(5-bromo-2-methoxyphenyl)-7-methyl-6-[(4-methylphenyl)methyl]-5-oxo-4H-pyrano[3,2-c]pyridine-3-carbonitrile Traditional Name: 2-amino-4-(5-bromo-2-methoxy-phenyl)-5-keto-7-methyl-6-(4-methylbenzyl)-4H-pyrano[3,2-c]pyridine-3-carbonitrile Formula: C25H22BrN3O3 MolecularWeight: 492.36448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=CC3=C(C2=O)C(C(=C(O3)N)C#N)C4=C(C=CC(=C4)Br)OC)C

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=CC3=C(C2=O)C(C(=C(O3)N)C#N)C4=C(C=CC(=C4)Br)OC)C

InChI

InChI=1S/C25H22BrN3O3/c1-14-4-6-16(7-5-14)13-29-15(2)10-21-23(25(29)30)22(19(12-27)24(28)32-21)18-11-17(26)8-9-20(18)31-3/h4-11,22H,13,28H2,1-3H3