N-(1,3-benzodioxol-5-ylmethyl)-5-nitro-2-(1,3-thiazol-2-ylamino)benzamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-5-nitro-2-(1,3-thiazol-2-ylamino)benzamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-5-nitro-2-(thiazol-2-ylamino)benzamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-5-nitro-2-(2-thiazolylamino)benzamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-5-nitro-2-(1,3-thiazol-2-ylamino)benzamide Traditional Name: 5-nitro-N-piperonyl-2-(thiazol-2-ylamino)benzamide Formula: C18H14N4O5S MolecularWeight: 398.39256

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])NC4=NC=CS4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])NC4=NC=CS4

InChI

InChI=1S/C18H14N4O5S/c23-17(20-9-11-1-4-15-16(7-11)27-10-26-15)13-8-12(22(24)25)2-3-14(13)21-18-19-5-6-28-18/h1-8H,9-10H2,(H,19,21)(H,20,23)