(E)-1-[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]-3-phenyl-prop-2-en-1-one

Systemtic Name: (E)-1-[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]-3-phenyl-prop-2-en-1-one Openeye Name: (E)-1-[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]-3-phenyl-prop-2-en-1-one CAS Name: (E)-1-[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]-3-phenyl-2-propen-1-one IUPAC Name: (E)-1-[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]-3-phenylprop-2-en-1-one Traditional Name: (E)-1-[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]-3-phenyl-prop-2-en-1-one Formula: C20H21FN2O3S MolecularWeight: 388.455743

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)S(=O)(=O)C2=CC=C(C=C2)F)C(=O)C=CC3=CC=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C20H21FN2O3S/c21-18-8-10-19(11-9-18)27(25,26)23-14-4-13-22(15-16-23)20(24)12-7-17-5-2-1-3-6-17/h1-3,5-12H,4,13-16H2/b12-7+