N-(1,3-benzothiazol-2-yl)-4-[(4-chloranylpyrazol-1-yl)methyl]benzamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-4-[(4-chloranylpyrazol-1-yl)methyl]benzamide Openeye Name: N-(1,3-benzothiazol-2-yl)-4-[(4-chloropyrazol-1-yl)methyl]benzamide CAS Name: N-(1,3-benzothiazol-2-yl)-4-[(4-chloro-1-pyrazolyl)methyl]benzamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-4-[(4-chloropyrazol-1-yl)methyl]benzamide Traditional Name: N-(1,3-benzothiazol-2-yl)-4-[(4-chloropyrazol-1-yl)methyl]benzamide Formula: C18H13ClN4OS MolecularWeight: 368.84002

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)NC(=O)C3=CC=C(C=C3)CN4C=C(C=N4)Cl

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)NC(=O)C3=CC=C(C=C3)CN4C=C(C=N4)Cl

InChI

InChI=1S/C18H13ClN4OS/c19-14-9-20-23(11-14)10-12-5-7-13(8-6-12)17(24)22-18-21-15-3-1-2-4-16(15)25-18/h1-9,11H,10H2,(H,21,22,24)