N-[3-[[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]carbonyl]naphthalen-2-yl]cyclopropanecarboxamide

Systemtic Name: N-[3-[[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]carbonyl]naphthalen-2-yl]cyclopropanecarboxamide Openeye Name: N-[3-[4-(4-fluorophenyl)sulfonyl-1,4-diazepane-1-carbonyl]-2-naphthyl]cyclopropanecarboxamide CAS Name: N-[3-[[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]-oxomethyl]-2-naphthalenyl]cyclopropanecarboxamide IUPAC Name: N-[3-[4-(4-fluorophenyl)sulfonyl-1,4-diazepane-1-carbonyl]naphthalen-2-yl]cyclopropanecarboxamide Traditional Name: N-[3-[4-(4-fluorophenyl)sulfonyl-1,4-diazepane-1-carbonyl]-2-naphthyl]cyclopropanecarboxamide Formula: C26H26FN3O4S MolecularWeight: 495.565743

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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=CC4=CC=CC=C4C=C3NC(=O)C5CC5

Isomeric SMILES

C1CN(CCN(C1)S(=O)(=O)C2=CC=C(C=C2)F)C(=O)C3=CC4=CC=CC=C4C=C3NC(=O)C5CC5

InChI

InChI=1S/C26H26FN3O4S/c27-21-8-10-22(11-9-21)35(33,34)30-13-3-12-29(14-15-30)26(32)23-16-19-4-1-2-5-20(19)17-24(23)28-25(31)18-6-7-18/h1-2,4-5,8-11,16-18H,3,6-7,12-15H2,(H,28,31)