N-(1,3-benzothiazol-2-ylmethyl)-1-phenyl-pyrazole-3-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-1-phenyl-pyrazole-3-carboxamide Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-1-phenyl-pyrazole-3-carboxamide CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-1-phenyl-3-pyrazolecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-1-phenylpyrazole-3-carboxamide Traditional Name: N-(1,3-benzothiazol-2-ylmethyl)-1-phenyl-pyrazole-3-carboxamide Formula: C18H14N4OS MolecularWeight: 334.39496

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=CC(=N2)C(=O)NCC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1=CC=C(C=C1)N2C=CC(=N2)C(=O)NCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C18H14N4OS/c23-18(15-10-11-22(21-15)13-6-2-1-3-7-13)19-12-17-20-14-8-4-5-9-16(14)24-17/h1-11H,12H2,(H,19,23)