N-[2,4-bis(fluoranyl)phenyl]-2-[4-[5-(1,2-oxazol-3-yl)thiophen-2-yl]sulfonyl-1,4-diazepan-1-yl]ethanamide

Systemtic Name: N-[2,4-bis(fluoranyl)phenyl]-2-[4-[5-(1,2-oxazol-3-yl)thiophen-2-yl]sulfonyl-1,4-diazepan-1-yl]ethanamide Openeye Name: N-(2,4-difluorophenyl)-2-[4-[(5-isoxazol-3-yl-2-thienyl)sulfonyl]-1,4-diazepan-1-yl]acetamide CAS Name: N-(2,4-difluorophenyl)-2-[4-[[5-(3-isoxazolyl)-2-thiophenyl]sulfonyl]-1,4-diazepan-1-yl]acetamide IUPAC Name: N-(2,4-difluorophenyl)-2-[4-[5-(1,2-oxazol-3-yl)thiophen-2-yl]sulfonyl-1,4-diazepan-1-yl]acetamide Traditional Name: N-(2,4-difluorophenyl)-2-[4-[(5-isoxazol-3-yl-2-thienyl)sulfonyl]-1,4-diazepan-1-yl]acetamide Formula: C20H20F2N4O4S2 MolecularWeight: 482.524006

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)S(=O)(=O)C2=CC=C(S2)C3=NOC=C3)CC(=O)NC4=C(C=C(C=C4)F)F

Isomeric SMILES

C1CN(CCN(C1)S(=O)(=O)C2=CC=C(S2)C3=NOC=C3)CC(=O)NC4=C(C=C(C=C4)F)F

InChI

InChI=1S/C20H20F2N4O4S2/c21-14-2-3-16(15(22)12-14)23-19(27)13-25-7-1-8-26(10-9-25)32(28,29)20-5-4-18(31-20)17-6-11-30-24-17/h2-6,11-12H,1,7-10,13H2,(H,23,27)