N-[1-[[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]-3-nitro-benzamide

Systemtic Name: N-[1-[[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]-3-nitro-benzamide Openeye Name: N-[1-benzyl-2-[[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]amino]-2-oxo-ethyl]-3-nitro-benzamide CAS Name: N-[1-[[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]-3-nitrobenzamide IUPAC Name: N-[1-[[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]-3-nitrobenzamide Traditional Name: N-[1-benzyl-2-[[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]amino]-2-keto-ethyl]-3-nitro-benzamide Formula: C24H18BrN5O4S MolecularWeight: 552.39982

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)NC2=NN=C(S2)C3=CC=C(C=C3)Br)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)NC2=NN=C(S2)C3=CC=C(C=C3)Br)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H18BrN5O4S/c25-18-11-9-16(10-12-18)23-28-29-24(35-23)27-22(32)20(13-15-5-2-1-3-6-15)26-21(31)17-7-4-8-19(14-17)30(33)34/h1-12,14,20H,13H2,(H,26,31)(H,27,29,32)