N-(2,4-dichlorophenyl)-5-(4-morpholin-4-yl-3-nitro-phenyl)-1,3,4-thiadiazol-2-amine

Systemtic Name: N-(2,4-dichlorophenyl)-5-(4-morpholin-4-yl-3-nitro-phenyl)-1,3,4-thiadiazol-2-amine Openeye Name: N-(2,4-dichlorophenyl)-5-(4-morpholino-3-nitro-phenyl)-1,3,4-thiadiazol-2-amine CAS Name: N-(2,4-dichlorophenyl)-5-[4-(4-morpholinyl)-3-nitrophenyl]-1,3,4-thiadiazol-2-amine IUPAC Name: N-(2,4-dichlorophenyl)-5-(4-morpholin-4-yl-3-nitrophenyl)-1,3,4-thiadiazol-2-amine Traditional Name: (2,4-dichlorophenyl)-[5-(4-morpholino-3-nitro-phenyl)-1,3,4-thiadiazol-2-yl]amine Formula: C18H15Cl2N5O3S MolecularWeight: 452.3144

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)C3=NN=C(S3)NC4=C(C=C(C=C4)Cl)Cl)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)C3=NN=C(S3)NC4=C(C=C(C=C4)Cl)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H15Cl2N5O3S/c19-12-2-3-14(13(20)10-12)21-18-23-22-17(29-18)11-1-4-15(16(9-11)25(26)27)24-5-7-28-8-6-24/h1-4,9-10H,5-8H2,(H,21,23)