1-[3,5-bis(trifluoromethyl)phenyl]sulfonyl-7-phenyl-1,4-diazepan-5-one

Systemtic Name: 1-[3,5-bis(trifluoromethyl)phenyl]sulfonyl-7-phenyl-1,4-diazepan-5-one Openeye Name: 1-[3,5-bis(trifluoromethyl)phenyl]sulfonyl-7-phenyl-1,4-diazepan-5-one CAS Name: 1-[3,5-bis(trifluoromethyl)phenyl]sulfonyl-7-phenyl-1,4-diazepan-5-one IUPAC Name: 1-[3,5-bis(trifluoromethyl)phenyl]sulfonyl-7-phenyl-1,4-diazepan-5-one Traditional Name: 1-[3,5-bis(trifluoromethyl)phenyl]sulfonyl-7-phenyl-1,4-diazepan-5-one Formula: C19H16F6N2O3S MolecularWeight: 466.397359

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CC(=O)N1)C2=CC=CC=C2)S(=O)(=O)C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

Isomeric SMILES

C1CN(C(CC(=O)N1)C2=CC=CC=C2)S(=O)(=O)C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C19H16F6N2O3S/c20-18(21,22)13-8-14(19(23,24)25)10-15(9-13)31(29,30)27-7-6-26-17(28)11-16(27)12-4-2-1-3-5-12/h1-5,8-10,16H,6-7,11H2,(H,26,28)