[1-[[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]amino]-1-oxidanylidene-butan-2-yl] 3-azanylbenzoate

Systemtic Name: [1-[[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]amino]-1-oxidanylidene-butan-2-yl] 3-azanylbenzoate Openeye Name: 1-[[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]carbamoyl]propyl 3-aminobenzoate CAS Name: 3-aminobenzoic acid [1-[4-[(4-methyl-2-pyrimidinyl)sulfamoyl]anilino]-1-oxobutan-2-yl] ester IUPAC Name: [1-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]anilino]-1-oxobutan-2-yl] 3-aminobenzoate Traditional Name: 3-aminobenzoic acid 1-[[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]carbamoyl]propyl ester Formula: C22H23N5O5S MolecularWeight: 469.51352

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=NC=CC(=N2)C)OC(=O)C3=CC(=CC=C3)N

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=NC=CC(=N2)C)OC(=O)C3=CC(=CC=C3)N

InChI

InChI=1S/C22H23N5O5S/c1-3-19(32-21(29)15-5-4-6-16(23)13-15)20(28)26-17-7-9-18(10-8-17)33(30,31)27-22-24-12-11-14(2)25-22/h4-13,19H,3,23H2,1-2H3,(H,26,28)(H,24,25,27)