6-azanyl-4-(2-bromanyl-4-butoxy-5-methoxy-phenyl)-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile

Systemtic Name: 6-azanyl-4-(2-bromanyl-4-butoxy-5-methoxy-phenyl)-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Openeye Name: 6-amino-4-(2-bromo-4-butoxy-5-methoxy-phenyl)-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile CAS Name: 6-amino-4-(2-bromo-4-butoxy-5-methoxyphenyl)-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile IUPAC Name: 6-amino-4-(2-bromo-4-butoxy-5-methoxyphenyl)-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Traditional Name: 6-amino-4-(2-bromo-4-butoxy-5-methoxy-phenyl)-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Formula: C19H21BrN4O3 MolecularWeight: 433.29904

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C(=C1)Br)C2C(=C(OC3=NNC(=C23)C)N)C#N)OC

Isomeric SMILES

CCCCOC1=C(C=C(C(=C1)Br)C2C(=C(OC3=NNC(=C23)C)N)C#N)OC

InChI

InChI=1S/C19H21BrN4O3/c1-4-5-6-26-15-8-13(20)11(7-14(15)25-3)17-12(9-21)18(22)27-19-16(17)10(2)23-24-19/h7-8,17H,4-6,22H2,1-3H3,(H,23,24)