1-[3,4-bis(fluoranyl)phenyl]sulfonyl-4-(thiophen-2-ylmethyl)-1,4-diazepane

Systemtic Name: 1-[3,4-bis(fluoranyl)phenyl]sulfonyl-4-(thiophen-2-ylmethyl)-1,4-diazepane Openeye Name: 1-(3,4-difluorophenyl)sulfonyl-4-(2-thienylmethyl)-1,4-diazepane CAS Name: 1-(3,4-difluorophenyl)sulfonyl-4-(thiophen-2-ylmethyl)-1,4-diazepane IUPAC Name: 1-(3,4-difluorophenyl)sulfonyl-4-(thiophen-2-ylmethyl)-1,4-diazepane Traditional Name: 1-(3,4-difluorophenyl)sulfonyl-4-(2-thenyl)-1,4-diazepane Formula: C16H18F2N2O2S2 MolecularWeight: 372.453126

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)F)F)CC3=CC=CS3

Isomeric SMILES

C1CN(CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)F)F)CC3=CC=CS3

InChI

InChI=1S/C16H18F2N2O2S2/c17-15-5-4-14(11-16(15)18)24(21,22)20-7-2-6-19(8-9-20)12-13-3-1-10-23-13/h1,3-5,10-11H,2,6-9,12H2