[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]-(4-methyl-2-phenyl-1,3-thiazol-5-yl)methanone

Systemtic Name: [4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]-(4-methyl-2-phenyl-1,3-thiazol-5-yl)methanone Openeye Name: [4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]-(4-methyl-2-phenyl-thiazol-5-yl)methanone CAS Name: [4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]-(4-methyl-2-phenyl-5-thiazolyl)methanone IUPAC Name: [4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]-(4-methyl-2-phenyl-1,3-thiazol-5-yl)methanone Traditional Name: [4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]-(4-methyl-2-phenyl-thiazol-5-yl)methanone Formula: C22H22FN3O3S2 MolecularWeight: 459.556783

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C2=CC=CC=C2)C(=O)N3CCCN(CC3)S(=O)(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=C(SC(=N1)C2=CC=CC=C2)C(=O)N3CCCN(CC3)S(=O)(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H22FN3O3S2/c1-16-20(30-21(24-16)17-6-3-2-4-7-17)22(27)25-12-5-13-26(15-14-25)31(28,29)19-10-8-18(23)9-11-19/h2-4,6-11H,5,12-15H2,1H3