N-[2-[(5-ethyl-1,3,4-thiadiazol-2-yl)carbamoyl]phenyl]-3,5-dinitro-benzamide

Systemtic Name: N-[2-[(5-ethyl-1,3,4-thiadiazol-2-yl)carbamoyl]phenyl]-3,5-dinitro-benzamide Openeye Name: N-[2-[(5-ethyl-1,3,4-thiadiazol-2-yl)carbamoyl]phenyl]-3,5-dinitro-benzamide CAS Name: N-[2-[[(5-ethyl-1,3,4-thiadiazol-2-yl)amino]-oxomethyl]phenyl]-3,5-dinitrobenzamide IUPAC Name: N-[2-[(5-ethyl-1,3,4-thiadiazol-2-yl)carbamoyl]phenyl]-3,5-dinitrobenzamide Traditional Name: N-[2-[(5-ethyl-1,3,4-thiadiazol-2-yl)carbamoyl]phenyl]-3,5-dinitro-benzamide Formula: C18H14N6O6S MolecularWeight: 442.40536

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(S1)NC(=O)C2=CC=CC=C2NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCC1=NN=C(S1)NC(=O)C2=CC=CC=C2NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C18H14N6O6S/c1-2-15-21-22-18(31-15)20-17(26)13-5-3-4-6-14(13)19-16(25)10-7-11(23(27)28)9-12(8-10)24(29)30/h3-9H,2H2,1H3,(H,19,25)(H,20,22,26)