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

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-1-[(2-chlorophenyl)methyl]pyrazole-4-carboxamide Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-1-[(2-chlorophenyl)methyl]pyrazole-4-carboxamide CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-1-[(2-chlorophenyl)methyl]-4-pyrazolecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-1-[(2-chlorophenyl)methyl]pyrazole-4-carboxamide Traditional Name: N-(1,3-benzothiazol-2-ylmethyl)-1-(2-chlorobenzyl)pyrazole-4-carboxamide Formula: C19H15ClN4OS MolecularWeight: 382.8666

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CN2C=C(C=N2)C(=O)NCC3=NC4=CC=CC=C4S3)Cl

Isomeric SMILES

C1=CC=C(C(=C1)CN2C=C(C=N2)C(=O)NCC3=NC4=CC=CC=C4S3)Cl

InChI

InChI=1S/C19H15ClN4OS/c20-15-6-2-1-5-13(15)11-24-12-14(9-22-24)19(25)21-10-18-23-16-7-3-4-8-17(16)26-18/h1-9,12H,10-11H2,(H,21,25)