5-(3-bromophenyl)-N-[(2-chlorophenyl)methyl]-3,4-dihydropyrazole-2-carbothioamide

Systemtic Name: 5-(3-bromophenyl)-N-[(2-chlorophenyl)methyl]-3,4-dihydropyrazole-2-carbothioamide Openeye Name: 5-(3-bromophenyl)-N-[(2-chlorophenyl)methyl]-3,4-dihydropyrazole-2-carbothioamide CAS Name: 5-(3-bromophenyl)-N-[(2-chlorophenyl)methyl]-3,4-dihydropyrazole-2-carbothioamide IUPAC Name: 5-(3-bromophenyl)-N-[(2-chlorophenyl)methyl]-3,4-dihydropyrazole-2-carbothioamide Traditional Name: 3-(3-bromophenyl)-N-(2-chlorobenzyl)-2-pyrazoline-1-carbothioamide Formula: C17H15BrClN3S MolecularWeight: 408.7431

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(N=C1C2=CC(=CC=C2)Br)C(=S)NCC3=CC=CC=C3Cl

Isomeric SMILES

C1CN(N=C1C2=CC(=CC=C2)Br)C(=S)NCC3=CC=CC=C3Cl

InChI

InChI=1S/C17H15BrClN3S/c18-14-6-3-5-12(10-14)16-8-9-22(21-16)17(23)20-11-13-4-1-2-7-15(13)19/h1-7,10H,8-9,11H2,(H,20,23)