3-[3-(4-ethanoylpiperazin-1-yl)-2-[(3-methoxy-4-nitro-phenyl)methylsulfamoylamino]-3-oxidanylidene-propyl]benzenecarboximidamide

Systemtic Name: 3-[3-(4-ethanoylpiperazin-1-yl)-2-[(3-methoxy-4-nitro-phenyl)methylsulfamoylamino]-3-oxidanylidene-propyl]benzenecarboximidamide Openeye Name: 3-[3-(4-acetylpiperazin-1-yl)-2-[(3-methoxy-4-nitro-phenyl)methylsulfamoylamino]-3-oxo-propyl]benzamidine CAS Name: 3-[3-(4-acetyl-1-piperazinyl)-2-[(3-methoxy-4-nitrophenyl)methylsulfamoylamino]-3-oxopropyl]benzenecarboximidamide IUPAC Name: 3-[3-(4-acetylpiperazin-1-yl)-2-[(3-methoxy-4-nitrophenyl)methylsulfamoylamino]-3-oxopropyl]benzenecarboximidamide Traditional Name: 3-[3-(4-acetylpiperazino)-3-keto-2-[(3-methoxy-4-nitro-benzyl)sulfamoylamino]propyl]benzamidine Formula: C24H31N7O7S MolecularWeight: 561.61064

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C(=O)C(CC2=CC=CC(=C2)C(=N)N)NS(=O)(=O)NCC3=CC(=C(C=C3)[N+](=O)[O-])OC

Isomeric SMILES

CC(=O)N1CCN(CC1)C(=O)C(CC2=CC=CC(=C2)C(=N)N)NS(=O)(=O)NCC3=CC(=C(C=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C24H31N7O7S/c1-16(32)29-8-10-30(11-9-29)24(33)20(13-17-4-3-5-19(12-17)23(25)26)28-39(36,37)27-15-18-6-7-21(31(34)35)22(14-18)38-2/h3-7,12,14,20,27-28H,8-11,13,15H2,1-2H3,(H3,25,26)