N-[4-[4-(6-fluoranyl-1-benzothiophen-3-yl)-1,4-diazepan-1-yl]butyl]naphthalene-2-carboxamide

Systemtic Name: N-[4-[4-(6-fluoranyl-1-benzothiophen-3-yl)-1,4-diazepan-1-yl]butyl]naphthalene-2-carboxamide Openeye Name: N-[4-[4-(6-fluorobenzothiophen-3-yl)-1,4-diazepan-1-yl]butyl]naphthalene-2-carboxamide CAS Name: N-[4-[4-(6-fluoro-1-benzothiophen-3-yl)-1,4-diazepan-1-yl]butyl]-2-naphthalenecarboxamide IUPAC Name: N-[4-[4-(6-fluoro-1-benzothiophen-3-yl)-1,4-diazepan-1-yl]butyl]naphthalene-2-carboxamide Traditional Name: N-[4-[4-(6-fluorobenzothiophen-3-yl)-1,4-diazepan-1-yl]butyl]-2-naphthamide Formula: C28H30FN3OS MolecularWeight: 475.620703

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C2=CSC3=C2C=CC(=C3)F)CCCCNC(=O)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

C1CN(CCN(C1)C2=CSC3=C2C=CC(=C3)F)CCCCNC(=O)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C28H30FN3OS/c29-24-10-11-25-26(20-34-27(25)19-24)32-15-5-14-31(16-17-32)13-4-3-12-30-28(33)23-9-8-21-6-1-2-7-22(21)18-23/h1-2,6-11,18-20H,3-5,12-17H2,(H,30,33)