pyrimidin-2-yl-[4-[4-(thiophen-2-ylcarbonylamino)butanoylamino]phenyl]sulfonyl-azanide

Systemtic Name: pyrimidin-2-yl-[4-[4-(thiophen-2-ylcarbonylamino)butanoylamino]phenyl]sulfonyl-azanide Openeye Name: pyrimidin-2-yl-[4-[4-(thiophene-2-carbonylamino)butanoylamino]phenyl]sulfonyl-azanide CAS Name: [4-[[1-oxo-4-[[oxo(thiophen-2-yl)methyl]amino]butyl]amino]phenyl]sulfonyl-(2-pyrimidinyl)azanide IUPAC Name: pyrimidin-2-yl-[4-[4-(thiophene-2-carbonylamino)butanoylamino]phenyl]sulfonylazanide Traditional Name: 2-pyrimidyl-[4-[4-(2-thenoylamino)butanoylamino]phenyl]sulfonyl-azanide Formula: C19H18N5O4S2- MolecularWeight: 444.50732

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)[N-]S(=O)(=O)C2=CC=C(C=C2)NC(=O)CCCNC(=O)C3=CC=CS3

Isomeric SMILES

C1=CN=C(N=C1)[N-]S(=O)(=O)C2=CC=C(C=C2)NC(=O)CCCNC(=O)C3=CC=CS3

InChI

InChI=1S/C19H19N5O4S2/c25-17(5-1-10-20-18(26)16-4-2-13-29-16)23-14-6-8-15(9-7-14)30(27,28)24-19-21-11-3-12-22-19/h2-4,6-9,11-13H,1,5,10H2,(H3,20,21,22,23,24,25,26)/p-1