4-ethoxy-5-methoxy-2-nitro-N-[5-(phenylmethyl)-1,3,4-thiadiazol-2-yl]benzamide

Systemtic Name: 4-ethoxy-5-methoxy-2-nitro-N-[5-(phenylmethyl)-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: N-(5-benzyl-1,3,4-thiadiazol-2-yl)-4-ethoxy-5-methoxy-2-nitro-benzamide CAS Name: 4-ethoxy-5-methoxy-2-nitro-N-[5-(phenylmethyl)-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: N-(5-benzyl-1,3,4-thiadiazol-2-yl)-4-ethoxy-5-methoxy-2-nitrobenzamide Traditional Name: N-(5-benzyl-1,3,4-thiadiazol-2-yl)-4-ethoxy-5-methoxy-2-nitro-benzamide Formula: C19H18N4O5S MolecularWeight: 414.43502

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)[N+](=O)[O-])C(=O)NC2=NN=C(S2)CC3=CC=CC=C3)OC

Isomeric SMILES

CCOC1=C(C=C(C(=C1)[N+](=O)[O-])C(=O)NC2=NN=C(S2)CC3=CC=CC=C3)OC

InChI

InChI=1S/C19H18N4O5S/c1-3-28-16-11-14(23(25)26)13(10-15(16)27-2)18(24)20-19-22-21-17(29-19)9-12-7-5-4-6-8-12/h4-8,10-11H,3,9H2,1-2H3,(H,20,22,24)