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

Systemtic Name: N-[1-[[5-(4-dimethylaminophenyl)-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-dimethylaminophenyl)-1,3,4-thiadiazol-2-yl]amino]-2-oxo-ethyl]-3-nitro-benzamide CAS Name: N-[1-[[5-(4-dimethylaminophenyl)-1,3,4-thiadiazol-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]-3-nitrobenzamide IUPAC Name: N-[1-[[5-(4-dimethylaminophenyl)-1,3,4-thiadiazol-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]-3-nitrobenzamide Traditional Name: N-[1-benzyl-2-[[5-(4-dimethylaminophenyl)-1,3,4-thiadiazol-2-yl]amino]-2-keto-ethyl]-3-nitro-benzamide Formula: C26H24N6O4S MolecularWeight: 516.57156

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C2=NN=C(S2)NC(=O)C(CC3=CC=CC=C3)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C2=NN=C(S2)NC(=O)C(CC3=CC=CC=C3)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C26H24N6O4S/c1-31(2)20-13-11-18(12-14-20)25-29-30-26(37-25)28-24(34)22(15-17-7-4-3-5-8-17)27-23(33)19-9-6-10-21(16-19)32(35)36/h3-14,16,22H,15H2,1-2H3,(H,27,33)(H,28,30,34)