[2-[[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]carbonyl]phenyl]-thiophen-2-yl-methanone

Systemtic Name: [2-[[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]carbonyl]phenyl]-thiophen-2-yl-methanone Openeye Name: [2-[4-(4-fluorophenyl)sulfonyl-1,4-diazepane-1-carbonyl]phenyl]-(2-thienyl)methanone CAS Name: [2-[[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]-oxomethyl]phenyl]-thiophen-2-ylmethanone IUPAC Name: [2-[4-(4-fluorophenyl)sulfonyl-1,4-diazepane-1-carbonyl]phenyl]-thiophen-2-ylmethanone Traditional Name: [2-[4-(4-fluorophenyl)sulfonyl-1,4-diazepane-1-carbonyl]phenyl]-(2-thienyl)methanone Formula: C23H21FN2O4S2 MolecularWeight: 472.552243

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)S(=O)(=O)C2=CC=C(C=C2)F)C(=O)C3=CC=CC=C3C(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCN(C1)S(=O)(=O)C2=CC=C(C=C2)F)C(=O)C3=CC=CC=C3C(=O)C4=CC=CS4

InChI

InChI=1S/C23H21FN2O4S2/c24-17-8-10-18(11-9-17)32(29,30)26-13-4-12-25(14-15-26)23(28)20-6-2-1-5-19(20)22(27)21-7-3-16-31-21/h1-3,5-11,16H,4,12-15H2