(4E)-2-(4-chlorophenyl)-5-methyl-4-(3-methyl-1,3-benzothiazol-2-ylidene)pyrazol-3-one

Systemtic Name: (4E)-2-(4-chlorophenyl)-5-methyl-4-(3-methyl-1,3-benzothiazol-2-ylidene)pyrazol-3-one Openeye Name: (4E)-2-(4-chlorophenyl)-5-methyl-4-(3-methyl-1,3-benzothiazol-2-ylidene)pyrazol-3-one CAS Name: (4E)-2-(4-chlorophenyl)-5-methyl-4-(3-methyl-1,3-benzothiazol-2-ylidene)-3-pyrazolone IUPAC Name: (4E)-2-(4-chlorophenyl)-5-methyl-4-(3-methyl-1,3-benzothiazol-2-ylidene)pyrazol-3-one Traditional Name: (4E)-2-(4-chlorophenyl)-5-methyl-4-(3-methyl-1,3-benzothiazol-2-ylidene)-2-pyrazolin-3-one Formula: C18H14ClN3OS MolecularWeight: 355.84126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=C2N(C3=CC=CC=C3S2)C)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC\1=NN(C(=O)/C1=C/2\N(C3=CC=CC=C3S2)C)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C18H14ClN3OS/c1-11-16(18-21(2)14-5-3-4-6-15(14)24-18)17(23)22(20-11)13-9-7-12(19)8-10-13/h3-10H,1-2H3/b18-16+