(4Z)-2-(1,3-benzothiazol-2-yl)-4-(dimethylaminomethylidene)-5-(4-methoxyphenyl)pyrazol-3-one

Systemtic Name: (4Z)-2-(1,3-benzothiazol-2-yl)-4-(dimethylaminomethylidene)-5-(4-methoxyphenyl)pyrazol-3-one Openeye Name: (4Z)-2-(1,3-benzothiazol-2-yl)-4-(dimethylaminomethylene)-5-(4-methoxyphenyl)pyrazol-3-one CAS Name: (4Z)-2-(1,3-benzothiazol-2-yl)-4-(dimethylaminomethylidene)-5-(4-methoxyphenyl)-3-pyrazolone IUPAC Name: (4Z)-2-(1,3-benzothiazol-2-yl)-4-(dimethylaminomethylidene)-5-(4-methoxyphenyl)pyrazol-3-one Traditional Name: (4Z)-2-(1,3-benzothiazol-2-yl)-4-(dimethylaminomethylene)-5-(4-methoxyphenyl)-2-pyrazolin-3-one Formula: C20H18N4O2S MolecularWeight: 378.44752

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H18N4O2S/c1-23(2)12-15-18(13-8-10-14(26-3)11-9-13)22-24(19(15)25)20-21-16-6-4-5-7-17(16)27-20/h4-12H,1-3H3/b15-12-