6-(azepan-1-ylmethylideneamino)-4-(4-methoxyphenyl)-3-methyl-1-phenyl-4H-pyrano[2,3-c]pyrazole-5-carbonitrile

Systemtic Name: 6-(azepan-1-ylmethylideneamino)-4-(4-methoxyphenyl)-3-methyl-1-phenyl-4H-pyrano[2,3-c]pyrazole-5-carbonitrile Openeye Name: 6-(azepan-1-ylmethyleneamino)-4-(4-methoxyphenyl)-3-methyl-1-phenyl-4H-pyrano[2,3-c]pyrazole-5-carbonitrile CAS Name: 6-(1-azepanylmethylideneamino)-4-(4-methoxyphenyl)-3-methyl-1-phenyl-4H-pyrano[2,3-c]pyrazole-5-carbonitrile IUPAC Name: 6-(azepan-1-ylmethylideneamino)-4-(4-methoxyphenyl)-3-methyl-1-phenyl-4H-pyrano[2,3-c]pyrazole-5-carbonitrile Traditional Name: 6-(azepan-1-ylmethyleneamino)-4-(4-methoxyphenyl)-3-methyl-1-phenyl-4H-pyrano[2,3-c]pyrazole-5-carbonitrile Formula: C28H29N5O2 MolecularWeight: 467.56216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(C(=C(O2)N=CN3CCCCCC3)C#N)C4=CC=C(C=C4)OC)C5=CC=CC=C5

Isomeric SMILES

CC1=NN(C2=C1C(C(=C(O2)N=CN3CCCCCC3)C#N)C4=CC=C(C=C4)OC)C5=CC=CC=C5

InChI

InChI=1S/C28H29N5O2/c1-20-25-26(21-12-14-23(34-2)15-13-21)24(18-29)27(30-19-32-16-8-3-4-9-17-32)35-28(25)33(31-20)22-10-6-5-7-11-22/h5-7,10-15,19,26H,3-4,8-9,16-17H2,1-2H3