5-azanyl-1-(4-bromophenyl)-3-phenylmethoxy-pyrazole-4-carbonitrile

Systemtic Name: 5-azanyl-1-(4-bromophenyl)-3-phenylmethoxy-pyrazole-4-carbonitrile Openeye Name: 5-amino-3-benzyloxy-1-(4-bromophenyl)pyrazole-4-carbonitrile CAS Name: 5-amino-1-(4-bromophenyl)-3-phenylmethoxy-4-pyrazolecarbonitrile IUPAC Name: 5-amino-1-(4-bromophenyl)-3-phenylmethoxypyrazole-4-carbonitrile Traditional Name: 5-amino-3-benzoxy-1-(4-bromophenyl)pyrazole-4-carbonitrile Formula: C17H13BrN4O MolecularWeight: 369.21532

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=NN(C(=C2C#N)N)C3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)COC2=NN(C(=C2C#N)N)C3=CC=C(C=C3)Br

InChI

InChI=1S/C17H13BrN4O/c18-13-6-8-14(9-7-13)22-16(20)15(10-19)17(21-22)23-11-12-4-2-1-3-5-12/h1-9H,11,20H2