5-azanyl-1-(4-bromophenyl)-3-butan-2-yloxy-pyrazole-4-carbonitrile

Systemtic Name: 5-azanyl-1-(4-bromophenyl)-3-butan-2-yloxy-pyrazole-4-carbonitrile Openeye Name: 5-amino-1-(4-bromophenyl)-3-sec-butoxy-pyrazole-4-carbonitrile CAS Name: 5-amino-1-(4-bromophenyl)-3-butan-2-yloxy-4-pyrazolecarbonitrile IUPAC Name: 5-amino-1-(4-bromophenyl)-3-butan-2-yloxypyrazole-4-carbonitrile Traditional Name: 5-amino-1-(4-bromophenyl)-3-sec-butoxy-pyrazole-4-carbonitrile Formula: C14H15BrN4O MolecularWeight: 335.1991

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC1=NN(C(=C1C#N)N)C2=CC=C(C=C2)Br

Isomeric SMILES

CCC(C)OC1=NN(C(=C1C#N)N)C2=CC=C(C=C2)Br

InChI

InChI=1S/C14H15BrN4O/c1-3-9(2)20-14-12(8-16)13(17)19(18-14)11-6-4-10(15)5-7-11/h4-7,9H,3,17H2,1-2H3