4-chloranyl-3-nitro-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)benzamide

Systemtic Name: 4-chloranyl-3-nitro-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)benzamide Openeye Name: 4-chloro-N-[5-(1-ethylpropyl)-1,3,4-thiadiazol-2-yl]-3-nitro-benzamide CAS Name: 4-chloro-3-nitro-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)benzamide IUPAC Name: 4-chloro-3-nitro-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)benzamide Traditional Name: 4-chloro-N-[5-(1-ethylpropyl)-1,3,4-thiadiazol-2-yl]-3-nitro-benzamide Formula: C14H15ClN4O3S MolecularWeight: 354.8119

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H15ClN4O3S/c1-3-8(4-2)13-17-18-14(23-13)16-12(20)9-5-6-10(15)11(7-9)19(21)22/h5-8H,3-4H2,1-2H3,(H,16,18,20)