5-[4-[4-(4-bromophenyl)-1,3-thiazol-2-yl]piperazin-1-yl]-2-nitro-N-(phenylmethyl)aniline

Systemtic Name: 5-[4-[4-(4-bromophenyl)-1,3-thiazol-2-yl]piperazin-1-yl]-2-nitro-N-(phenylmethyl)aniline Openeye Name: N-benzyl-5-[4-[4-(4-bromophenyl)thiazol-2-yl]piperazin-1-yl]-2-nitro-aniline CAS Name: 5-[4-[4-(4-bromophenyl)-2-thiazolyl]-1-piperazinyl]-2-nitro-N-(phenylmethyl)aniline IUPAC Name: N-benzyl-5-[4-[4-(4-bromophenyl)-1,3-thiazol-2-yl]piperazin-1-yl]-2-nitroaniline Traditional Name: benzyl-[5-[4-[4-(4-bromophenyl)thiazol-2-yl]piperazino]-2-nitro-phenyl]amine Formula: C26H24BrN5O2S MolecularWeight: 550.47006

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=C(C=C2)[N+](=O)[O-])NCC3=CC=CC=C3)C4=NC(=CS4)C5=CC=C(C=C5)Br

Isomeric SMILES

C1CN(CCN1C2=CC(=C(C=C2)[N+](=O)[O-])NCC3=CC=CC=C3)C4=NC(=CS4)C5=CC=C(C=C5)Br

InChI

InChI=1S/C26H24BrN5O2S/c27-21-8-6-20(7-9-21)24-18-35-26(29-24)31-14-12-30(13-15-31)22-10-11-25(32(33)34)23(16-22)28-17-19-4-2-1-3-5-19/h1-11,16,18,28H,12-15,17H2