4-[5-(2-chloranyl-4-nitro-phenyl)sulfanyl-4-cyclopropyl-1,2,4-triazol-3-yl]morpholine

Systemtic Name: 4-[5-(2-chloranyl-4-nitro-phenyl)sulfanyl-4-cyclopropyl-1,2,4-triazol-3-yl]morpholine Openeye Name: 4-[5-(2-chloro-4-nitro-phenyl)sulfanyl-4-cyclopropyl-1,2,4-triazol-3-yl]morpholine CAS Name: 4-[5-[(2-chloro-4-nitrophenyl)thio]-4-cyclopropyl-1,2,4-triazol-3-yl]morpholine IUPAC Name: 4-[5-(2-chloro-4-nitrophenyl)sulfanyl-4-cyclopropyl-1,2,4-triazol-3-yl]morpholine Traditional Name: 4-[5-[(2-chloro-4-nitro-phenyl)thio]-4-cyclopropyl-1,2,4-triazol-3-yl]morpholine Formula: C15H16ClN5O3S MolecularWeight: 381.83724

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN=C2SC3=C(C=C(C=C3)[N+](=O)[O-])Cl)N4CCOCC4

Isomeric SMILES

C1CC1N2C(=NN=C2SC3=C(C=C(C=C3)[N+](=O)[O-])Cl)N4CCOCC4

InChI

InChI=1S/C15H16ClN5O3S/c16-12-9-11(21(22)23)3-4-13(12)25-15-18-17-14(20(15)10-1-2-10)19-5-7-24-8-6-19/h3-4,9-10H,1-2,5-8H2