(4Z)-2-(1,3-benzothiazol-2-yl)-5-propyl-4-[1-(pyridin-3-ylamino)ethylidene]pyrazol-3-one

Systemtic Name: (4Z)-2-(1,3-benzothiazol-2-yl)-5-propyl-4-[1-(pyridin-3-ylamino)ethylidene]pyrazol-3-one Openeye Name: (4Z)-2-(1,3-benzothiazol-2-yl)-5-propyl-4-[1-(3-pyridylamino)ethylidene]pyrazol-3-one CAS Name: (4Z)-2-(1,3-benzothiazol-2-yl)-5-propyl-4-[1-(3-pyridinylamino)ethylidene]-3-pyrazolone IUPAC Name: (4Z)-2-(1,3-benzothiazol-2-yl)-5-propyl-4-[1-(pyridin-3-ylamino)ethylidene]pyrazol-3-one Traditional Name: (4Z)-2-(1,3-benzothiazol-2-yl)-5-propyl-4-[1-(3-pyridylamino)ethylidene]-2-pyrazolin-3-one Formula: C20H19N5OS MolecularWeight: 377.46276

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=O)C1=C(C)NC2=CN=CC=C2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CCCC\1=NN(C(=O)/C1=C(/C)\NC2=CN=CC=C2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H19N5OS/c1-3-7-16-18(13(2)22-14-8-6-11-21-12-14)19(26)25(24-16)20-23-15-9-4-5-10-17(15)27-20/h4-6,8-12,22H,3,7H2,1-2H3/b18-13-