N-[3-(1,3-benzothiazol-2-yl)propyl]-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-1-phenyl-pyrazole-4-carboxamide Openeye Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-1-phenyl-pyrazole-4-carboxamide CAS Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-1-phenyl-4-pyrazolecarboxamide IUPAC Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-1-phenylpyrazole-4-carboxamide Traditional Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-1-phenyl-pyrazole-4-carboxamide Formula: C20H18N4OS MolecularWeight: 362.44812

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C=N2)C(=O)NCCCC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C=N2)C(=O)NCCCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H18N4OS/c25-20(15-13-22-24(14-15)16-7-2-1-3-8-16)21-12-6-11-19-23-17-9-4-5-10-18(17)26-19/h1-5,7-10,13-14H,6,11-12H2,(H,21,25)