N-[5-[(3,4-dichlorophenyl)methylamino]-1,3,4-thiadiazol-2-yl]-5-nitro-furan-2-carboxamide

Systemtic Name: N-[5-[(3,4-dichlorophenyl)methylamino]-1,3,4-thiadiazol-2-yl]-5-nitro-furan-2-carboxamide Openeye Name: N-[5-[(3,4-dichlorophenyl)methylamino]-1,3,4-thiadiazol-2-yl]-5-nitro-furan-2-carboxamide CAS Name: N-[5-[(3,4-dichlorophenyl)methylamino]-1,3,4-thiadiazol-2-yl]-5-nitro-2-furancarboxamide IUPAC Name: N-[5-[(3,4-dichlorophenyl)methylamino]-1,3,4-thiadiazol-2-yl]-5-nitrofuran-2-carboxamide Traditional Name: N-[5-[(3,4-dichlorobenzyl)amino]-1,3,4-thiadiazol-2-yl]-5-nitro-2-furamide Formula: C14H9Cl2N5O4S MolecularWeight: 414.22336

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CNC2=NN=C(S2)NC(=O)C3=CC=C(O3)[N+](=O)[O-])Cl)Cl

Isomeric SMILES

C1=CC(=C(C=C1CNC2=NN=C(S2)NC(=O)C3=CC=C(O3)[N+](=O)[O-])Cl)Cl

InChI

InChI=1S/C14H9Cl2N5O4S/c15-8-2-1-7(5-9(8)16)6-17-13-19-20-14(26-13)18-12(22)10-3-4-11(25-10)21(23)24/h1-5H,6H2,(H,17,19)(H,18,20,22)