[4-[4-[methyl(thiophen-2-ylsulfonyl)amino]butanoylamino]phenyl]sulfonyl-pyrimidin-2-yl-azanide

Systemtic Name: [4-[4-[methyl(thiophen-2-ylsulfonyl)amino]butanoylamino]phenyl]sulfonyl-pyrimidin-2-yl-azanide Openeye Name: [4-[4-[methyl(2-thienylsulfonyl)amino]butanoylamino]phenyl]sulfonyl-pyrimidin-2-yl-azanide CAS Name: [4-[[4-[methyl(thiophen-2-ylsulfonyl)amino]-1-oxobutyl]amino]phenyl]sulfonyl-(2-pyrimidinyl)azanide IUPAC Name: [4-[4-[methyl(thiophen-2-ylsulfonyl)amino]butanoylamino]phenyl]sulfonyl-pyrimidin-2-ylazanide Traditional Name: [4-[4-[methyl(2-thienylsulfonyl)amino]butanoylamino]phenyl]sulfonyl-(2-pyrimidyl)azanide Formula: C19H20N5O5S3- MolecularWeight: 494.5876

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC(=O)NC1=CC=C(C=C1)S(=O)(=O)[N-]C2=NC=CC=N2)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CN(CCCC(=O)NC1=CC=C(C=C1)S(=O)(=O)[N-]C2=NC=CC=N2)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C19H21N5O5S3/c1-24(32(28,29)18-6-3-14-30-18)13-2-5-17(25)22-15-7-9-16(10-8-15)31(26,27)23-19-20-11-4-12-21-19/h3-4,6-12,14H,2,5,13H2,1H3,(H2,20,21,22,23,25)/p-1