1-(4-chlorophenyl)sulfonyl-4-(4,6-dimethylpyrimidin-2-yl)-1,4-diazepane

Systemtic Name: 1-(4-chlorophenyl)sulfonyl-4-(4,6-dimethylpyrimidin-2-yl)-1,4-diazepane Openeye Name: 1-(4-chlorophenyl)sulfonyl-4-(4,6-dimethylpyrimidin-2-yl)-1,4-diazepane CAS Name: 1-(4-chlorophenyl)sulfonyl-4-(4,6-dimethyl-2-pyrimidinyl)-1,4-diazepane IUPAC Name: 1-(4-chlorophenyl)sulfonyl-4-(4,6-dimethylpyrimidin-2-yl)-1,4-diazepane Traditional Name: 1-(4-chlorophenyl)sulfonyl-4-(4,6-dimethylpyrimidin-2-yl)-1,4-diazepane Formula: C17H21ClN4O2S MolecularWeight: 380.89224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2CCCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl)C

Isomeric SMILES

CC1=CC(=NC(=N1)N2CCCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl)C

InChI

InChI=1S/C17H21ClN4O2S/c1-13-12-14(2)20-17(19-13)21-8-3-9-22(11-10-21)25(23,24)16-6-4-15(18)5-7-16/h4-7,12H,3,8-11H2,1-2H3