3-nitro-N-[2-oxidanylidene-2-[(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)amino]ethyl]benzamide

Systemtic Name: 3-nitro-N-[2-oxidanylidene-2-[(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)amino]ethyl]benzamide Openeye Name: N-[2-[[5-(1-ethylpropyl)-1,3,4-thiadiazol-2-yl]amino]-2-oxo-ethyl]-3-nitro-benzamide CAS Name: 3-nitro-N-[2-oxo-2-[(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)amino]ethyl]benzamide IUPAC Name: 3-nitro-N-[2-oxo-2-[(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)amino]ethyl]benzamide Traditional Name: N-[2-[[5-(1-ethylpropyl)-1,3,4-thiadiazol-2-yl]amino]-2-keto-ethyl]-3-nitro-benzamide Formula: C16H19N5O4S MolecularWeight: 377.41816

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C1=NN=C(S1)NC(=O)CNC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCC(CC)C1=NN=C(S1)NC(=O)CNC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H19N5O4S/c1-3-10(4-2)15-19-20-16(26-15)18-13(22)9-17-14(23)11-6-5-7-12(8-11)21(24)25/h5-8,10H,3-4,9H2,1-2H3,(H,17,23)(H,18,20,22)