2-[(4-methylphenyl)sulfonylamino]-N-[6-phenoxathiin-2-yl-4-(phenylmethyl)pyridazin-3-yl]propanamide

Systemtic Name: 2-[(4-methylphenyl)sulfonylamino]-N-[6-phenoxathiin-2-yl-4-(phenylmethyl)pyridazin-3-yl]propanamide Openeye Name: N-(4-benzyl-6-phenoxathiin-2-yl-pyridazin-3-yl)-2-(p-tolylsulfonylamino)propanamide CAS Name: 2-[(4-methylphenyl)sulfonylamino]-N-[6-(2-phenoxathiinyl)-4-(phenylmethyl)-3-pyridazinyl]propanamide IUPAC Name: N-(4-benzyl-6-phenoxathiin-2-ylpyridazin-3-yl)-2-[(4-methylphenyl)sulfonylamino]propanamide Traditional Name: N-(4-benzyl-6-phenoxathiin-2-yl-pyridazin-3-yl)-2-(tosylamino)propionamide Formula: C33H28N4O4S2 MolecularWeight: 608.72982

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C)C(=O)NC2=NN=C(C=C2CC3=CC=CC=C3)C4=CC5=C(C=C4)OC6=CC=CC=C6S5

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(C)C(=O)NC2=NN=C(C=C2CC3=CC=CC=C3)C4=CC5=C(C=C4)OC6=CC=CC=C6S5

InChI

InChI=1S/C33H28N4O4S2/c1-21-12-15-26(16-13-21)43(39,40)37-22(2)33(38)34-32-25(18-23-8-4-3-5-9-23)19-27(35-36-32)24-14-17-29-31(20-24)42-30-11-7-6-10-28(30)41-29/h3-17,19-20,22,37H,18H2,1-2H3,(H,34,36,38)