6-[(2-fluorophenyl)methoxy]-1-[(4-methoxyphenyl)methyl]-4-thiophen-3-ylcarbonyl-1,4-diazepan-2-one

Systemtic Name: 6-[(2-fluorophenyl)methoxy]-1-[(4-methoxyphenyl)methyl]-4-thiophen-3-ylcarbonyl-1,4-diazepan-2-one Openeye Name: 6-[(2-fluorophenyl)methoxy]-1-[(4-methoxyphenyl)methyl]-4-(thiophene-3-carbonyl)-1,4-diazepan-2-one CAS Name: 6-[(2-fluorophenyl)methoxy]-1-[(4-methoxyphenyl)methyl]-4-[oxo(3-thiophenyl)methyl]-1,4-diazepan-2-one IUPAC Name: 6-[(2-fluorophenyl)methoxy]-1-[(4-methoxyphenyl)methyl]-4-(thiophene-3-carbonyl)-1,4-diazepan-2-one Traditional Name: 6-(2-fluorobenzyl)oxy-1-p-anisyl-4-(3-thenoyl)-1,4-diazepan-2-one Formula: C25H25FN2O4S MolecularWeight: 468.540403

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2CC(CN(CC2=O)C(=O)C3=CSC=C3)OCC4=CC=CC=C4F

Isomeric SMILES

COC1=CC=C(C=C1)CN2CC(CN(CC2=O)C(=O)C3=CSC=C3)OCC4=CC=CC=C4F

InChI

InChI=1S/C25H25FN2O4S/c1-31-21-8-6-18(7-9-21)12-27-13-22(32-16-19-4-2-3-5-23(19)26)14-28(15-24(27)29)25(30)20-10-11-33-17-20/h2-11,17,22H,12-16H2,1H3