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

Systemtic Name: 6-azanyl-4-(3-methoxy-4-phenyl-phenyl)-3-(phenoxymethyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Openeye Name: 6-amino-4-(3-methoxy-4-phenyl-phenyl)-3-(phenoxymethyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile CAS Name: 6-amino-4-(3-methoxy-4-phenylphenyl)-3-(phenoxymethyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile IUPAC Name: 6-amino-4-(3-methoxy-4-phenylphenyl)-3-(phenoxymethyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Traditional Name: 6-amino-4-(3-methoxy-4-phenyl-phenyl)-3-(phenoxymethyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Formula: C27H22N4O3 MolecularWeight: 450.48858

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2C(=C(OC3=NNC(=C23)COC4=CC=CC=C4)N)C#N)C5=CC=CC=C5

Isomeric SMILES

COC1=C(C=CC(=C1)C2C(=C(OC3=NNC(=C23)COC4=CC=CC=C4)N)C#N)C5=CC=CC=C5

InChI

InChI=1S/C27H22N4O3/c1-32-23-14-18(12-13-20(23)17-8-4-2-5-9-17)24-21(15-28)26(29)34-27-25(24)22(30-31-27)16-33-19-10-6-3-7-11-19/h2-14,24H,16,29H2,1H3,(H,30,31)