N-[3-nitro-4-(2-phenylsulfanylethylamino)phenyl]sulfonyl-4-(thiophen-3-ylmethoxy)benzamide

Systemtic Name: N-[3-nitro-4-(2-phenylsulfanylethylamino)phenyl]sulfonyl-4-(thiophen-3-ylmethoxy)benzamide Openeye Name: N-[3-nitro-4-(2-phenylsulfanylethylamino)phenyl]sulfonyl-4-(3-thienylmethoxy)benzamide CAS Name: N-[3-nitro-4-[2-(phenylthio)ethylamino]phenyl]sulfonyl-4-(3-thiophenylmethoxy)benzamide IUPAC Name: N-[3-nitro-4-(2-phenylsulfanylethylamino)phenyl]sulfonyl-4-(thiophen-3-ylmethoxy)benzamide Traditional Name: N-[3-nitro-4-[2-(phenylthio)ethylamino]phenyl]sulfonyl-4-(3-thenyloxy)benzamide Formula: C26H23N3O6S3 MolecularWeight: 569.67232

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCCNC2=C(C=C(C=C2)S(=O)(=O)NC(=O)C3=CC=C(C=C3)OCC4=CSC=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)SCCNC2=C(C=C(C=C2)S(=O)(=O)NC(=O)C3=CC=C(C=C3)OCC4=CSC=C4)[N+](=O)[O-]

InChI

InChI=1S/C26H23N3O6S3/c30-26(20-6-8-21(9-7-20)35-17-19-12-14-36-18-19)28-38(33,34)23-10-11-24(25(16-23)29(31)32)27-13-15-37-22-4-2-1-3-5-22/h1-12,14,16,18,27H,13,15,17H2,(H,28,30)