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

Systemtic Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-1-[(2-chlorophenyl)methyl]pyrazole-4-carboxamide Openeye Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-1-[(2-chlorophenyl)methyl]pyrazole-4-carboxamide CAS Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-1-[(2-chlorophenyl)methyl]-4-pyrazolecarboxamide IUPAC Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-1-[(2-chlorophenyl)methyl]pyrazole-4-carboxamide Traditional Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-1-(2-chlorobenzyl)pyrazole-4-carboxamide Formula: C24H17ClN4OS MolecularWeight: 444.93598

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CN2C=C(C=N2)C(=O)NC3=CC=CC=C3C4=NC5=CC=CC=C5S4)Cl

Isomeric SMILES

C1=CC=C(C(=C1)CN2C=C(C=N2)C(=O)NC3=CC=CC=C3C4=NC5=CC=CC=C5S4)Cl

InChI

InChI=1S/C24H17ClN4OS/c25-19-9-3-1-7-16(19)14-29-15-17(13-26-29)23(30)27-20-10-4-2-8-18(20)24-28-21-11-5-6-12-22(21)31-24/h1-13,15H,14H2,(H,27,30)