3,5-bis(4-bromophenyl)-N-(phenylmethyl)-3,4-dihydropyrazole-2-carbothioamide

Systemtic Name: 3,5-bis(4-bromophenyl)-N-(phenylmethyl)-3,4-dihydropyrazole-2-carbothioamide Openeye Name: N-benzyl-3,5-bis(4-bromophenyl)-3,4-dihydropyrazole-2-carbothioamide CAS Name: 3,5-bis(4-bromophenyl)-N-(phenylmethyl)-3,4-dihydropyrazole-2-carbothioamide IUPAC Name: N-benzyl-3,5-bis(4-bromophenyl)-3,4-dihydropyrazole-2-carbothioamide Traditional Name: N-benzyl-3,5-bis(4-bromophenyl)-2-pyrazoline-1-carbothioamide Formula: C23H19Br2N3S MolecularWeight: 529.29006

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(N=C1C2=CC=C(C=C2)Br)C(=S)NCC3=CC=CC=C3)C4=CC=C(C=C4)Br

Isomeric SMILES

C1C(N(N=C1C2=CC=C(C=C2)Br)C(=S)NCC3=CC=CC=C3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C23H19Br2N3S/c24-19-10-6-17(7-11-19)21-14-22(18-8-12-20(25)13-9-18)28(27-21)23(29)26-15-16-4-2-1-3-5-16/h1-13,22H,14-15H2,(H,26,29)