2-(1-pyrimidin-2-ylimidazol-2-yl)sulfonylethyl N-[4-(diethylamino)-2-methyl-phenyl]carbamate

Systemtic Name: 2-(1-pyrimidin-2-ylimidazol-2-yl)sulfonylethyl N-[4-(diethylamino)-2-methyl-phenyl]carbamate Openeye Name: 2-(1-pyrimidin-2-ylimidazol-2-yl)sulfonylethyl N-[4-(diethylamino)-2-methyl-phenyl]carbamate CAS Name: N-[4-(diethylamino)-2-methylphenyl]carbamic acid 2-[[1-(2-pyrimidinyl)-2-imidazolyl]sulfonyl]ethyl ester IUPAC Name: 2-(1-pyrimidin-2-ylimidazol-2-yl)sulfonylethyl N-[4-(diethylamino)-2-methylphenyl]carbamate Traditional Name: N-[4-(diethylamino)-2-methyl-phenyl]carbamic acid 2-[1-(2-pyrimidyl)imidazol-2-yl]sulfonylethyl ester Formula: C21H26N6O4S MolecularWeight: 458.53394

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC(=C(C=C1)NC(=O)OCCS(=O)(=O)C2=NC=CN2C3=NC=CC=N3)C

Isomeric SMILES

CCN(CC)C1=CC(=C(C=C1)NC(=O)OCCS(=O)(=O)C2=NC=CN2C3=NC=CC=N3)C

InChI

InChI=1S/C21H26N6O4S/c1-4-26(5-2)17-7-8-18(16(3)15-17)25-21(28)31-13-14-32(29,30)20-24-11-12-27(20)19-22-9-6-10-23-19/h6-12,15H,4-5,13-14H2,1-3H3,(H,25,28)