2-morpholin-4-ylsulfonyl-4-nitro-N-[(2-phenyl-1,3-thiazol-4-yl)methyl]aniline

Systemtic Name: 2-morpholin-4-ylsulfonyl-4-nitro-N-[(2-phenyl-1,3-thiazol-4-yl)methyl]aniline Openeye Name: 2-morpholinosulfonyl-4-nitro-N-[(2-phenylthiazol-4-yl)methyl]aniline CAS Name: 2-(4-morpholinylsulfonyl)-4-nitro-N-[(2-phenyl-4-thiazolyl)methyl]aniline IUPAC Name: 2-morpholin-4-ylsulfonyl-4-nitro-N-[(2-phenyl-1,3-thiazol-4-yl)methyl]aniline Traditional Name: (2-morpholinosulfonyl-4-nitro-phenyl)-[(2-phenylthiazol-4-yl)methyl]amine Formula: C20H20N4O5S2 MolecularWeight: 460.5266

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NCC3=CSC(=N3)C4=CC=CC=C4

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NCC3=CSC(=N3)C4=CC=CC=C4

InChI

InChI=1S/C20H20N4O5S2/c25-24(26)17-6-7-18(19(12-17)31(27,28)23-8-10-29-11-9-23)21-13-16-14-30-20(22-16)15-4-2-1-3-5-15/h1-7,12,14,21H,8-11,13H2