(4Z)-2-(1,3-benzothiazol-2-yl)-4-[1-(3-ethoxypropylamino)ethylidene]-5-phenyl-pyrazol-3-one

Systemtic Name: (4Z)-2-(1,3-benzothiazol-2-yl)-4-[1-(3-ethoxypropylamino)ethylidene]-5-phenyl-pyrazol-3-one Openeye Name: (4Z)-2-(1,3-benzothiazol-2-yl)-4-[1-(3-ethoxypropylamino)ethylidene]-5-phenyl-pyrazol-3-one CAS Name: (4Z)-2-(1,3-benzothiazol-2-yl)-4-[1-(3-ethoxypropylamino)ethylidene]-5-phenyl-3-pyrazolone IUPAC Name: (4Z)-2-(1,3-benzothiazol-2-yl)-4-[1-(3-ethoxypropylamino)ethylidene]-5-phenylpyrazol-3-one Traditional Name: (4Z)-2-(1,3-benzothiazol-2-yl)-4-[1-(3-ethoxypropylamino)ethylidene]-5-phenyl-2-pyrazolin-3-one Formula: C23H24N4O2S MolecularWeight: 420.52726

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNC(=C1C(=NN(C1=O)C2=NC3=CC=CC=C3S2)C4=CC=CC=C4)C

Isomeric SMILES

CCOCCCN/C(=C\1/C(=NN(C1=O)C2=NC3=CC=CC=C3S2)C4=CC=CC=C4)/C

InChI

InChI=1S/C23H24N4O2S/c1-3-29-15-9-14-24-16(2)20-21(17-10-5-4-6-11-17)26-27(22(20)28)23-25-18-12-7-8-13-19(18)30-23/h4-8,10-13,24H,3,9,14-15H2,1-2H3/b20-16-