N-(2-azanyl-5-thiophen-2-yl-phenyl)-4-[2-(methylamino)-1-(methylsulfonylamino)-2-oxidanylidene-ethyl]benzamide

Systemtic Name: N-(2-azanyl-5-thiophen-2-yl-phenyl)-4-[2-(methylamino)-1-(methylsulfonylamino)-2-oxidanylidene-ethyl]benzamide Openeye Name: N-[2-amino-5-(2-thienyl)phenyl]-4-[1-(methanesulfonamido)-2-(methylamino)-2-oxo-ethyl]benzamide CAS Name: N-(2-amino-5-thiophen-2-ylphenyl)-4-[1-(methanesulfonamido)-2-(methylamino)-2-oxoethyl]benzamide IUPAC Name: N-(2-amino-5-thiophen-2-ylphenyl)-4-[1-(methanesulfonamido)-2-(methylamino)-2-oxoethyl]benzamide Traditional Name: N-[2-amino-5-(2-thienyl)phenyl]-4-[2-keto-1-(methanesulfonamido)-2-(methylamino)ethyl]benzamide Formula: C21H22N4O4S2 MolecularWeight: 458.55378

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C(C1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)C3=CC=CS3)N)NS(=O)(=O)C

Isomeric SMILES

CNC(=O)C(C1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)C3=CC=CS3)N)NS(=O)(=O)C

InChI

InChI=1S/C21H22N4O4S2/c1-23-21(27)19(25-31(2,28)29)13-5-7-14(8-6-13)20(26)24-17-12-15(9-10-16(17)22)18-4-3-11-30-18/h3-12,19,25H,22H2,1-2H3,(H,23,27)(H,24,26)