3-[3-(4-naphthalen-2-ylcarbonylpiperazin-1-yl)-2-(naphthalen-2-ylsulfonylamino)-3-oxidanylidene-propyl]benzenecarboximidamide

Systemtic Name: 3-[3-(4-naphthalen-2-ylcarbonylpiperazin-1-yl)-2-(naphthalen-2-ylsulfonylamino)-3-oxidanylidene-propyl]benzenecarboximidamide Openeye Name: 3-[3-[4-(naphthalene-2-carbonyl)piperazin-1-yl]-2-(2-naphthylsulfonylamino)-3-oxo-propyl]benzamidine CAS Name: 3-[3-[4-[2-naphthalenyl(oxo)methyl]-1-piperazinyl]-2-(2-naphthalenylsulfonylamino)-3-oxopropyl]benzenecarboximidamide IUPAC Name: 3-[3-[4-(naphthalene-2-carbonyl)piperazin-1-yl]-2-(naphthalen-2-ylsulfonylamino)-3-oxopropyl]benzenecarboximidamide Traditional Name: 3-[3-keto-3-[4-(2-naphthoyl)piperazino]-2-(2-naphthylsulfonylamino)propyl]benzamidine Formula: C35H33N5O4S MolecularWeight: 619.73262

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC3=CC=CC=C3C=C2)C(=O)C(CC4=CC=CC(=C4)C(=N)N)NS(=O)(=O)C5=CC6=CC=CC=C6C=C5

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC3=CC=CC=C3C=C2)C(=O)C(CC4=CC=CC(=C4)C(=N)N)NS(=O)(=O)C5=CC6=CC=CC=C6C=C5

InChI

InChI=1S/C35H33N5O4S/c36-33(37)29-11-5-6-24(20-29)21-32(38-45(43,44)31-15-14-26-8-2-4-10-28(26)23-31)35(42)40-18-16-39(17-19-40)34(41)30-13-12-25-7-1-3-9-27(25)22-30/h1-15,20,22-23,32,38H,16-19,21H2,(H3,36,37)