(4Z)-2-(1,3-benzothiazol-2-yl)-5-phenyl-4-[(2-piperazin-1-ylethylamino)methylidene]pyrazol-3-one

Systemtic Name: (4Z)-2-(1,3-benzothiazol-2-yl)-5-phenyl-4-[(2-piperazin-1-ylethylamino)methylidene]pyrazol-3-one Openeye Name: (4Z)-2-(1,3-benzothiazol-2-yl)-5-phenyl-4-[(2-piperazin-1-ylethylamino)methylene]pyrazol-3-one CAS Name: (4Z)-2-(1,3-benzothiazol-2-yl)-5-phenyl-4-[[2-(1-piperazinyl)ethylamino]methylidene]-3-pyrazolone IUPAC Name: (4Z)-2-(1,3-benzothiazol-2-yl)-5-phenyl-4-[(2-piperazin-1-ylethylamino)methylidene]pyrazol-3-one Traditional Name: (4Z)-2-(1,3-benzothiazol-2-yl)-5-phenyl-4-[(2-piperazinoethylamino)methylene]-2-pyrazolin-3-one Formula: C23H24N6OS MolecularWeight: 432.54126

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)CCNC=C2C(=NN(C2=O)C3=NC4=CC=CC=C4S3)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1)CCN/C=C\2/C(=NN(C2=O)C3=NC4=CC=CC=C4S3)C5=CC=CC=C5

InChI

InChI=1S/C23H24N6OS/c30-22-18(16-25-12-15-28-13-10-24-11-14-28)21(17-6-2-1-3-7-17)27-29(22)23-26-19-8-4-5-9-20(19)31-23/h1-9,16,24-25H,10-15H2/b18-16-