4-[4-[(2-phenyl-1,3-thiazol-5-yl)carbonyl]piperazin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 4-[4-[(2-phenyl-1,3-thiazol-5-yl)carbonyl]piperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 4-[4-(2-phenylthiazole-5-carbonyl)piperazin-1-yl]sulfonylbenzonitrile CAS Name: 4-[[4-[oxo-(2-phenyl-5-thiazolyl)methyl]-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 4-[4-(2-phenyl-1,3-thiazole-5-carbonyl)piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 4-[4-(2-phenylthiazole-5-carbonyl)piperazino]sulfonylbenzonitrile Formula: C21H18N4O3S2 MolecularWeight: 438.52262

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CN=C(S2)C3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)C#N

Isomeric SMILES

C1CN(CCN1C(=O)C2=CN=C(S2)C3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C21H18N4O3S2/c22-14-16-6-8-18(9-7-16)30(27,28)25-12-10-24(11-13-25)21(26)19-15-23-20(29-19)17-4-2-1-3-5-17/h1-9,15H,10-13H2