4-[4-(5-cyclopropyl-2-phenyl-pyrazol-3-yl)carbonylpiperazin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 4-[4-(5-cyclopropyl-2-phenyl-pyrazol-3-yl)carbonylpiperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 4-[4-(5-cyclopropyl-2-phenyl-pyrazole-3-carbonyl)piperazin-1-yl]sulfonylbenzonitrile CAS Name: 4-[[4-[(5-cyclopropyl-2-phenyl-3-pyrazolyl)-oxomethyl]-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 4-[4-(5-cyclopropyl-2-phenylpyrazole-3-carbonyl)piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 4-[4-(5-cyclopropyl-2-phenyl-pyrazole-3-carbonyl)piperazino]sulfonylbenzonitrile Formula: C24H23N5O3S MolecularWeight: 461.53612

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NN(C(=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C#N)C5=CC=CC=C5

Isomeric SMILES

C1CC1C2=NN(C(=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C#N)C5=CC=CC=C5

InChI

InChI=1S/C24H23N5O3S/c25-17-18-6-10-21(11-7-18)33(31,32)28-14-12-27(13-15-28)24(30)23-16-22(19-8-9-19)26-29(23)20-4-2-1-3-5-20/h1-7,10-11,16,19H,8-9,12-15H2