4-(cyclopropylamino)-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]-3-nitro-benzamide

Systemtic Name: 4-(cyclopropylamino)-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]-3-nitro-benzamide Openeye Name: 4-(cyclopropylamino)-N-[(2-morpholinosulfonylphenyl)methyl]-3-nitro-benzamide CAS Name: 4-(cyclopropylamino)-N-[[2-(4-morpholinylsulfonyl)phenyl]methyl]-3-nitrobenzamide IUPAC Name: 4-(cyclopropylamino)-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]-3-nitrobenzamide Traditional Name: 4-(cyclopropylamino)-N-(2-morpholinosulfonylbenzyl)-3-nitro-benzamide Formula: C21H24N4O6S MolecularWeight: 460.50346

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC2=C(C=C(C=C2)C(=O)NCC3=CC=CC=C3S(=O)(=O)N4CCOCC4)[N+](=O)[O-]

Isomeric SMILES

C1CC1NC2=C(C=C(C=C2)C(=O)NCC3=CC=CC=C3S(=O)(=O)N4CCOCC4)[N+](=O)[O-]

InChI

InChI=1S/C21H24N4O6S/c26-21(15-5-8-18(23-17-6-7-17)19(13-15)25(27)28)22-14-16-3-1-2-4-20(16)32(29,30)24-9-11-31-12-10-24/h1-5,8,13,17,23H,6-7,9-12,14H2,(H,22,26)