3-[3-(4-ethanoylpiperazin-1-yl)-3-oxidanylidene-2-[(6-oxidanylnaphthalen-1-yl)methylsulfamoylamino]propyl]benzenecarboximidamide

Systemtic Name: 3-[3-(4-ethanoylpiperazin-1-yl)-3-oxidanylidene-2-[(6-oxidanylnaphthalen-1-yl)methylsulfamoylamino]propyl]benzenecarboximidamide Openeye Name: 3-[3-(4-acetylpiperazin-1-yl)-2-[(6-hydroxy-1-naphthyl)methylsulfamoylamino]-3-oxo-propyl]benzamidine CAS Name: 3-[3-(4-acetyl-1-piperazinyl)-2-[(6-hydroxy-1-naphthalenyl)methylsulfamoylamino]-3-oxopropyl]benzenecarboximidamide IUPAC Name: 3-[3-(4-acetylpiperazin-1-yl)-2-[(6-hydroxynaphthalen-1-yl)methylsulfamoylamino]-3-oxopropyl]benzenecarboximidamide Traditional Name: 3-[3-(4-acetylpiperazino)-2-[(6-hydroxy-1-naphthyl)methylsulfamoylamino]-3-keto-propyl]benzamidine Formula: C27H32N6O5S MolecularWeight: 552.64518

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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=CC4=C3C=CC(=C4)O

Isomeric SMILES

CC(=O)N1CCN(CC1)C(=O)C(CC2=CC=CC(=C2)C(=N)N)NS(=O)(=O)NCC3=CC=CC4=C3C=CC(=C4)O

InChI

InChI=1S/C27H32N6O5S/c1-18(34)32-10-12-33(13-11-32)27(36)25(15-19-4-2-6-21(14-19)26(28)29)31-39(37,38)30-17-22-7-3-5-20-16-23(35)8-9-24(20)22/h2-9,14,16,25,30-31,35H,10-13,15,17H2,1H3,(H3,28,29)