N-(4-bromophenyl)-4-(4-nitrophenyl)piperazine-1-carbothioamide

Systemtic Name: N-(4-bromophenyl)-4-(4-nitrophenyl)piperazine-1-carbothioamide Openeye Name: N-(4-bromophenyl)-4-(4-nitrophenyl)piperazine-1-carbothioamide CAS Name: N-(4-bromophenyl)-4-(4-nitrophenyl)-1-piperazinecarbothioamide IUPAC Name: N-(4-bromophenyl)-4-(4-nitrophenyl)piperazine-1-carbothioamide Traditional Name: N-(4-bromophenyl)-4-(4-nitrophenyl)piperazine-1-carbothioamide Formula: C17H17BrN4O2S MolecularWeight: 421.31148

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=S)NC3=CC=C(C=C3)Br

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=S)NC3=CC=C(C=C3)Br

InChI

InChI=1S/C17H17BrN4O2S/c18-13-1-3-14(4-2-13)19-17(25)21-11-9-20(10-12-21)15-5-7-16(8-6-15)22(23)24/h1-8H,9-12H2,(H,19,25)