4-(4-methylsulfonyl-1,4-diazepan-1-yl)-2-(trifluoromethyl)quinazoline

Systemtic Name: 4-(4-methylsulfonyl-1,4-diazepan-1-yl)-2-(trifluoromethyl)quinazoline Openeye Name: 4-(4-methylsulfonyl-1,4-diazepan-1-yl)-2-(trifluoromethyl)quinazoline CAS Name: 4-(4-methylsulfonyl-1,4-diazepan-1-yl)-2-(trifluoromethyl)quinazoline IUPAC Name: 4-(4-methylsulfonyl-1,4-diazepan-1-yl)-2-(trifluoromethyl)quinazoline Traditional Name: 4-(4-mesyl-1,4-diazepan-1-yl)-2-(trifluoromethyl)quinazoline Formula: C15H17F3N4O2S MolecularWeight: 374.38129

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCCN(CC1)C2=NC(=NC3=CC=CC=C32)C(F)(F)F

Isomeric SMILES

CS(=O)(=O)N1CCCN(CC1)C2=NC(=NC3=CC=CC=C32)C(F)(F)F

InChI

InChI=1S/C15H17F3N4O2S/c1-25(23,24)22-8-4-7-21(9-10-22)13-11-5-2-3-6-12(11)19-14(20-13)15(16,17)18/h2-3,5-6H,4,7-10H2,1H3