1-(2-diethylaminoethyl)-N-(4-morpholin-4-ylsulfonyl-2-nitro-phenyl)pyrazol-4-amine

Systemtic Name: 1-(2-diethylaminoethyl)-N-(4-morpholin-4-ylsulfonyl-2-nitro-phenyl)pyrazol-4-amine Openeye Name: 1-(2-diethylaminoethyl)-N-(4-morpholinosulfonyl-2-nitro-phenyl)pyrazol-4-amine CAS Name: 1-(2-diethylaminoethyl)-N-[4-(4-morpholinylsulfonyl)-2-nitrophenyl]-4-pyrazolamine IUPAC Name: 1-(2-diethylaminoethyl)-N-(4-morpholin-4-ylsulfonyl-2-nitrophenyl)pyrazol-4-amine Traditional Name: diethyl-[2-[4-(4-morpholinosulfonyl-2-nitro-anilino)pyrazol-1-yl]ethyl]amine Formula: C19H28N6O5S MolecularWeight: 452.52782

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN1C=C(C=N1)NC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)CCN1C=C(C=N1)NC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C19H28N6O5S/c1-3-22(4-2)7-8-23-15-16(14-20-23)21-18-6-5-17(13-19(18)25(26)27)31(28,29)24-9-11-30-12-10-24/h5-6,13-15,21H,3-4,7-12H2,1-2H3