4-[4-[5-(1,3-benzothiazol-2-yl)furan-2-yl]carbonylpiperazin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 4-[4-[5-(1,3-benzothiazol-2-yl)furan-2-yl]carbonylpiperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 4-[4-[5-(1,3-benzothiazol-2-yl)furan-2-carbonyl]piperazin-1-yl]sulfonylbenzonitrile CAS Name: 4-[[4-[[5-(1,3-benzothiazol-2-yl)-2-furanyl]-oxomethyl]-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 4-[4-[5-(1,3-benzothiazol-2-yl)furan-2-carbonyl]piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 4-[4-[5-(1,3-benzothiazol-2-yl)-2-furoyl]piperazino]sulfonylbenzonitrile Formula: C23H18N4O4S2 MolecularWeight: 478.54342

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC=C(O2)C3=NC4=CC=CC=C4S3)S(=O)(=O)C5=CC=C(C=C5)C#N

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC=C(O2)C3=NC4=CC=CC=C4S3)S(=O)(=O)C5=CC=C(C=C5)C#N

InChI

InChI=1S/C23H18N4O4S2/c24-15-16-5-7-17(8-6-16)33(29,30)27-13-11-26(12-14-27)23(28)20-10-9-19(31-20)22-25-18-3-1-2-4-21(18)32-22/h1-10H,11-14H2