(3R)-3-[2,2-bis(oxidanylidene)-1-propan-2-yl-2$l^{6},1,3-benzothiadiazol-3-yl]-3-(3-chloranyl-5-fluoranyl-phenyl)-N-methyl-propan-1-amine hydrochloride

Systemtic Name: (3R)-3-[2,2-bis(oxidanylidene)-1-propan-2-yl-2$l^{6},1,3-benzothiadiazol-3-yl]-3-(3-chloranyl-5-fluoranyl-phenyl)-N-methyl-propan-1-amine hydrochloride Openeye Name: (3R)-3-(3-chloro-5-fluoro-phenyl)-3-(1-isopropyl-2,2-dioxo-2$l^{6},1,3-benzothiadiazol-3-yl)-N-methyl-propan-1-amine hydrochloride CAS Name: (3R)-3-(3-chloro-5-fluorophenyl)-3-(2,2-dioxo-1-propan-2-yl-2$l^{6},1,3-benzothiadiazol-3-yl)-N-methyl-1-propanamine hydrochloride IUPAC Name: (3R)-3-(3-chloro-5-fluorophenyl)-3-(2,2-dioxo-1-propan-2-yl-2$l^{6},1,3-benzothiadiazol-3-yl)-N-methylpropan-1-amine hydrochloride Traditional Name: [(3R)-3-(3-chloro-5-fluoro-phenyl)-3-(3-isopropyl-2,2-diketo-piazthiol-1-yl)propyl]-methyl-amine hydrochloride Formula: C19H24Cl2FN3O2S MolecularWeight: 448.382163

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=CC=CC=C2N(S1(=O)=O)C(CCNC)C3=CC(=CC(=C3)Cl)F.Cl

Isomeric SMILES

CC(C)N1C2=CC=CC=C2N(S1(=O)=O)[C@H](CCNC)C3=CC(=CC(=C3)Cl)F.Cl

InChI

InChI=1S/C19H23ClFN3O2S.ClH/c1-13(2)23-18-6-4-5-7-19(18)24(27(23,25)26)17(8-9-22-3)14-10-15(20)12-16(21)11-14;/h4-7,10-13,17,22H,8-9H2,1-3H3;1H/t17-;/m1./s1