(4E)-2-(1,3-benzothiazol-2-yl)-5-methyl-4-[1-(3-pyrazol-1-ylpropylamino)ethylidene]pyrazol-3-one

Systemtic Name: (4E)-2-(1,3-benzothiazol-2-yl)-5-methyl-4-[1-(3-pyrazol-1-ylpropylamino)ethylidene]pyrazol-3-one Openeye Name: (4E)-2-(1,3-benzothiazol-2-yl)-5-methyl-4-[1-(3-pyrazol-1-ylpropylamino)ethylidene]pyrazol-3-one CAS Name: (4E)-2-(1,3-benzothiazol-2-yl)-5-methyl-4-[1-[3-(1-pyrazolyl)propylamino]ethylidene]-3-pyrazolone IUPAC Name: (4E)-2-(1,3-benzothiazol-2-yl)-5-methyl-4-[1-(3-pyrazol-1-ylpropylamino)ethylidene]pyrazol-3-one Traditional Name: (4E)-2-(1,3-benzothiazol-2-yl)-5-methyl-4-[1-(3-pyrazol-1-ylpropylamino)ethylidene]-2-pyrazolin-3-one Formula: C19H20N6OS MolecularWeight: 380.4667

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=C(C)NCCCN2C=CC=N2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CC\1=NN(C(=O)/C1=C(\C)/NCCCN2C=CC=N2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C19H20N6OS/c1-13(20-9-5-11-24-12-6-10-21-24)17-14(2)23-25(18(17)26)19-22-15-7-3-4-8-16(15)27-19/h3-4,6-8,10,12,20H,5,9,11H2,1-2H3/b17-13+