1-[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]-4-thiophen-2-yl-butane-1,4-dione

Systemtic Name: 1-[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]-4-thiophen-2-yl-butane-1,4-dione Openeye Name: 1-[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]-4-(2-thienyl)butane-1,4-dione CAS Name: 1-[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]-4-thiophen-2-ylbutane-1,4-dione IUPAC Name: 1-[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]-4-thiophen-2-ylbutane-1,4-dione Traditional Name: 1-[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]-4-(2-thienyl)butane-1,4-dione Formula: C19H21FN2O4S2 MolecularWeight: 424.509443

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)S(=O)(=O)C2=CC=C(C=C2)F)C(=O)CCC(=O)C3=CC=CS3

Isomeric SMILES

C1CN(CCN(C1)S(=O)(=O)C2=CC=C(C=C2)F)C(=O)CCC(=O)C3=CC=CS3

InChI

InChI=1S/C19H21FN2O4S2/c20-15-4-6-16(7-5-15)28(25,26)22-11-2-10-21(12-13-22)19(24)9-8-17(23)18-3-1-14-27-18/h1,3-7,14H,2,8-13H2